Project ID: plumID:21.017
Source: plumed/md/cry_c36m.dat
Originally used with PLUMED version: 2.5
Stable: zipped raw stdout - zipped raw stderr - stderr
Master: zipped raw stdout - zipped raw stderr - stderr
Click on the labels of the actions for more information on what each action computes
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MOLINFOThis command is used to provide information on the molecules that are present in your system. More detailsSTRUCTURE=../topologies/cry_c36m.pdb prot:a file in pdb format containing a reference structureGROUPDefine a group of atoms so that a particular list of atoms can be referenced with a single label in definitions of CVs or virtual atoms. More detailsATOMS=1-3436the numerical indexes for the set of atoms in the groupWHOLEMOLECULESThis action is used to rebuild molecules that can become split by the periodic boundary conditions. More detailsENTITY0=protthe atoms that make up a molecule that you wish to alignCONTACTMAP...Calculate the distances between a number of pairs of atoms and transform each distance by a switching function. More detailsATOMS1=5,52the atoms involved in each of the contacts you wish to calculateSWITCH1={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5610604286193848}The switching functions to use for each of the contacts in your mapWEIGHT1=0.001272264631043257A weight value for a given contact, by default is 1ATOMS2=5,62the atoms involved in each of the contacts you wish to calculateSWITCH2={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5481842160224915}The switching functions to use for each of the contacts in your mapWEIGHT2=0.001272264631043257A weight value for a given contact, by default is 1ATOMS3=5,2614the atoms involved in each of the contacts you wish to calculateSWITCH3={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5456867218017578}The switching functions to use for each of the contacts in your mapWEIGHT3=0.001272264631043257A weight value for a given contact, by default is 1ATOMS4=7,52the atoms involved in each of the contacts you wish to calculateSWITCH4={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5997282862663269}The switching functions to use for each of the contacts in your mapWEIGHT4=0.001272264631043257A weight value for a given contact, by default is 1ATOMS5=7,62the atoms involved in each of the contacts you wish to calculateSWITCH5={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5182827711105347}The switching functions to use for each of the contacts in your mapWEIGHT5=0.001272264631043257A weight value for a given contact, by default is 1ATOMS6=7,65the atoms involved in each of the contacts you wish to calculateSWITCH6={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5618842840194702}The switching functions to use for each of the contacts in your mapWEIGHT6=0.001272264631043257A weight value for a given contact, by default is 1ATOMS7=7,2614the atoms involved in each of the contacts you wish to calculateSWITCH7={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48425087332725525}The switching functions to use for each of the contacts in your mapWEIGHT7=0.001272264631043257A weight value for a given contact, by default is 1ATOMS8=7,2615the atoms involved in each of the contacts you wish to calculateSWITCH8={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5417128205299377}The switching functions to use for each of the contacts in your mapWEIGHT8=0.001272264631043257A weight value for a given contact, by default is 1ATOMS9=10,62the atoms involved in each of the contacts you wish to calculateSWITCH9={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5702253580093384}The switching functions to use for each of the contacts in your mapWEIGHT9=0.001272264631043257A weight value for a given contact, by default is 1ATOMS10=10,2611the atoms involved in each of the contacts you wish to calculateSWITCH10={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5790070295333862}The switching functions to use for each of the contacts in your mapWEIGHT10=0.001272264631043257A weight value for a given contact, by default is 1ATOMS11=10,2614the atoms involved in each of the contacts you wish to calculateSWITCH11={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.40627458691596985}The switching functions to use for each of the contacts in your mapWEIGHT11=0.001272264631043257A weight value for a given contact, by default is 1ATOMS12=10,2615the atoms involved in each of the contacts you wish to calculateSWITCH12={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4314267039299011}The switching functions to use for each of the contacts in your mapWEIGHT12=0.001272264631043257A weight value for a given contact, by default is 1ATOMS13=13,2611the atoms involved in each of the contacts you wish to calculateSWITCH13={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5995940566062927}The switching functions to use for each of the contacts in your mapWEIGHT13=0.001272264631043257A weight value for a given contact, by default is 1ATOMS14=13,2614the atoms involved in each of the contacts you wish to calculateSWITCH14={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4261091947555542}The switching functions to use for each of the contacts in your mapWEIGHT14=0.001272264631043257A weight value for a given contact, by default is 1ATOMS15=13,2615the atoms involved in each of the contacts you wish to calculateSWITCH15={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3946555256843567}The switching functions to use for each of the contacts in your mapWEIGHT15=0.001272264631043257A weight value for a given contact, by default is 1ATOMS16=14,62the atoms involved in each of the contacts you wish to calculateSWITCH16={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5443353056907654}The switching functions to use for each of the contacts in your mapWEIGHT16=0.001272264631043257A weight value for a given contact, by default is 1ATOMS17=14,65the atoms involved in each of the contacts you wish to calculateSWITCH17={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.536426842212677}The switching functions to use for each of the contacts in your mapWEIGHT17=0.001272264631043257A weight value for a given contact, by default is 1ATOMS18=14,2546the atoms involved in each of the contacts you wish to calculateSWITCH18={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5706994533538818}The switching functions to use for each of the contacts in your mapWEIGHT18=0.001272264631043257A weight value for a given contact, by default is 1ATOMS19=14,2562the atoms involved in each of the contacts you wish to calculateSWITCH19={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5421658158302307}The switching functions to use for each of the contacts in your mapWEIGHT19=0.001272264631043257A weight value for a given contact, by default is 1ATOMS20=14,2614the atoms involved in each of the contacts you wish to calculateSWITCH20={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.42671898007392883}The switching functions to use for each of the contacts in your mapWEIGHT20=0.001272264631043257A weight value for a given contact, by default is 1ATOMS21=14,2615the atoms involved in each of the contacts you wish to calculateSWITCH21={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.39910271763801575}The switching functions to use for each of the contacts in your mapWEIGHT21=0.001272264631043257A weight value for a given contact, by default is 1ATOMS22=15,2614the atoms involved in each of the contacts you wish to calculateSWITCH22={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4941588342189789}The switching functions to use for each of the contacts in your mapWEIGHT22=0.001272264631043257A weight value for a given contact, by default is 1ATOMS23=15,2615the atoms involved in each of the contacts you wish to calculateSWITCH23={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4235575497150421}The switching functions to use for each of the contacts in your mapWEIGHT23=0.001272264631043257A weight value for a given contact, by default is 1ATOMS24=16,52the atoms involved in each of the contacts you wish to calculateSWITCH24={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5171670913696289}The switching functions to use for each of the contacts in your mapWEIGHT24=0.001272264631043257A weight value for a given contact, by default is 1ATOMS25=16,56the atoms involved in each of the contacts you wish to calculateSWITCH25={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5684268474578857}The switching functions to use for each of the contacts in your mapWEIGHT25=0.001272264631043257A weight value for a given contact, by default is 1ATOMS26=16,62the atoms involved in each of the contacts you wish to calculateSWITCH26={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49320268630981445}The switching functions to use for each of the contacts in your mapWEIGHT26=0.001272264631043257A weight value for a given contact, by default is 1ATOMS27=16,65the atoms involved in each of the contacts you wish to calculateSWITCH27={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5956858992576599}The switching functions to use for each of the contacts in your mapWEIGHT27=0.001272264631043257A weight value for a given contact, by default is 1ATOMS28=16,2614the atoms involved in each of the contacts you wish to calculateSWITCH28={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.46076998114585876}The switching functions to use for each of the contacts in your mapWEIGHT28=0.001272264631043257A weight value for a given contact, by default is 1ATOMS29=16,2615the atoms involved in each of the contacts you wish to calculateSWITCH29={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5792917609214783}The switching functions to use for each of the contacts in your mapWEIGHT29=0.001272264631043257A weight value for a given contact, by default is 1ATOMS30=16,2678the atoms involved in each of the contacts you wish to calculateSWITCH30={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5951782464981079}The switching functions to use for each of the contacts in your mapWEIGHT30=0.001272264631043257A weight value for a given contact, by default is 1ATOMS31=16,2679the atoms involved in each of the contacts you wish to calculateSWITCH31={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5030578374862671}The switching functions to use for each of the contacts in your mapWEIGHT31=0.001272264631043257A weight value for a given contact, by default is 1ATOMS32=17,62the atoms involved in each of the contacts you wish to calculateSWITCH32={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5814033150672913}The switching functions to use for each of the contacts in your mapWEIGHT32=0.001272264631043257A weight value for a given contact, by default is 1ATOMS33=17,2611the atoms involved in each of the contacts you wish to calculateSWITCH33={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5894521474838257}The switching functions to use for each of the contacts in your mapWEIGHT33=0.001272264631043257A weight value for a given contact, by default is 1ATOMS34=17,2614the atoms involved in each of the contacts you wish to calculateSWITCH34={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4694271385669708}The switching functions to use for each of the contacts in your mapWEIGHT34=0.001272264631043257A weight value for a given contact, by default is 1ATOMS35=17,2615the atoms involved in each of the contacts you wish to calculateSWITCH35={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5813930034637451}The switching functions to use for each of the contacts in your mapWEIGHT35=0.001272264631043257A weight value for a given contact, by default is 1ATOMS36=17,2675the atoms involved in each of the contacts you wish to calculateSWITCH36={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5904388427734375}The switching functions to use for each of the contacts in your mapWEIGHT36=0.001272264631043257A weight value for a given contact, by default is 1ATOMS37=17,2678the atoms involved in each of the contacts you wish to calculateSWITCH37={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5472659468650818}The switching functions to use for each of the contacts in your mapWEIGHT37=0.001272264631043257A weight value for a given contact, by default is 1ATOMS38=17,2679the atoms involved in each of the contacts you wish to calculateSWITCH38={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4415496587753296}The switching functions to use for each of the contacts in your mapWEIGHT38=0.001272264631043257A weight value for a given contact, by default is 1ATOMS39=18,71the atoms involved in each of the contacts you wish to calculateSWITCH39={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5508483052253723}The switching functions to use for each of the contacts in your mapWEIGHT39=0.001272264631043257A weight value for a given contact, by default is 1ATOMS40=18,2608the atoms involved in each of the contacts you wish to calculateSWITCH40={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5420581102371216}The switching functions to use for each of the contacts in your mapWEIGHT40=0.001272264631043257A weight value for a given contact, by default is 1ATOMS41=18,2611the atoms involved in each of the contacts you wish to calculateSWITCH41={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5533843040466309}The switching functions to use for each of the contacts in your mapWEIGHT41=0.001272264631043257A weight value for a given contact, by default is 1ATOMS42=18,2614the atoms involved in each of the contacts you wish to calculateSWITCH42={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.42547157406806946}The switching functions to use for each of the contacts in your mapWEIGHT42=0.001272264631043257A weight value for a given contact, by default is 1ATOMS43=18,2615the atoms involved in each of the contacts you wish to calculateSWITCH43={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5710954666137695}The switching functions to use for each of the contacts in your mapWEIGHT43=0.001272264631043257A weight value for a given contact, by default is 1ATOMS44=18,2675the atoms involved in each of the contacts you wish to calculateSWITCH44={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5590439438819885}The switching functions to use for each of the contacts in your mapWEIGHT44=0.001272264631043257A weight value for a given contact, by default is 1ATOMS45=18,2678the atoms involved in each of the contacts you wish to calculateSWITCH45={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5582616925239563}The switching functions to use for each of the contacts in your mapWEIGHT45=0.001272264631043257A weight value for a given contact, by default is 1ATOMS46=18,2679the atoms involved in each of the contacts you wish to calculateSWITCH46={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48837918043136597}The switching functions to use for each of the contacts in your mapWEIGHT46=0.001272264631043257A weight value for a given contact, by default is 1ATOMS47=20,71the atoms involved in each of the contacts you wish to calculateSWITCH47={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4890744686126709}The switching functions to use for each of the contacts in your mapWEIGHT47=0.001272264631043257A weight value for a given contact, by default is 1ATOMS48=20,73the atoms involved in each of the contacts you wish to calculateSWITCH48={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5911750793457031}The switching functions to use for each of the contacts in your mapWEIGHT48=0.001272264631043257A weight value for a given contact, by default is 1ATOMS49=20,75the atoms involved in each of the contacts you wish to calculateSWITCH49={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5654979348182678}The switching functions to use for each of the contacts in your mapWEIGHT49=0.001272264631043257A weight value for a given contact, by default is 1ATOMS50=20,2606the atoms involved in each of the contacts you wish to calculateSWITCH50={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5720219016075134}The switching functions to use for each of the contacts in your mapWEIGHT50=0.001272264631043257A weight value for a given contact, by default is 1ATOMS51=20,2608the atoms involved in each of the contacts you wish to calculateSWITCH51={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44389525055885315}The switching functions to use for each of the contacts in your mapWEIGHT51=0.001272264631043257A weight value for a given contact, by default is 1ATOMS52=20,2611the atoms involved in each of the contacts you wish to calculateSWITCH52={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48659440875053406}The switching functions to use for each of the contacts in your mapWEIGHT52=0.001272264631043257A weight value for a given contact, by default is 1ATOMS53=20,2614the atoms involved in each of the contacts you wish to calculateSWITCH53={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.401021271944046}The switching functions to use for each of the contacts in your mapWEIGHT53=0.001272264631043257A weight value for a given contact, by default is 1ATOMS54=20,2615the atoms involved in each of the contacts you wish to calculateSWITCH54={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5696542859077454}The switching functions to use for each of the contacts in your mapWEIGHT54=0.001272264631043257A weight value for a given contact, by default is 1ATOMS55=20,2619the atoms involved in each of the contacts you wish to calculateSWITCH55={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5692669749259949}The switching functions to use for each of the contacts in your mapWEIGHT55=0.001272264631043257A weight value for a given contact, by default is 1ATOMS56=20,2620the atoms involved in each of the contacts you wish to calculateSWITCH56={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5451880097389221}The switching functions to use for each of the contacts in your mapWEIGHT56=0.001272264631043257A weight value for a given contact, by default is 1ATOMS57=20,2672the atoms involved in each of the contacts you wish to calculateSWITCH57={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5684055089950562}The switching functions to use for each of the contacts in your mapWEIGHT57=0.001272264631043257A weight value for a given contact, by default is 1ATOMS58=20,2675the atoms involved in each of the contacts you wish to calculateSWITCH58={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4271697700023651}The switching functions to use for each of the contacts in your mapWEIGHT58=0.001272264631043257A weight value for a given contact, by default is 1ATOMS59=20,2678the atoms involved in each of the contacts you wish to calculateSWITCH59={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44676169753074646}The switching functions to use for each of the contacts in your mapWEIGHT59=0.001272264631043257A weight value for a given contact, by default is 1ATOMS60=20,2679the atoms involved in each of the contacts you wish to calculateSWITCH60={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3918955624103546}The switching functions to use for each of the contacts in your mapWEIGHT60=0.001272264631043257A weight value for a given contact, by default is 1ATOMS61=20,2680the atoms involved in each of the contacts you wish to calculateSWITCH61={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5688945651054382}The switching functions to use for each of the contacts in your mapWEIGHT61=0.001272264631043257A weight value for a given contact, by default is 1ATOMS62=23,71the atoms involved in each of the contacts you wish to calculateSWITCH62={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.39653247594833374}The switching functions to use for each of the contacts in your mapWEIGHT62=0.001272264631043257A weight value for a given contact, by default is 1ATOMS63=23,73the atoms involved in each of the contacts you wish to calculateSWITCH63={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4847557842731476}The switching functions to use for each of the contacts in your mapWEIGHT63=0.001272264631043257A weight value for a given contact, by default is 1ATOMS64=23,75the atoms involved in each of the contacts you wish to calculateSWITCH64={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44378378987312317}The switching functions to use for each of the contacts in your mapWEIGHT64=0.001272264631043257A weight value for a given contact, by default is 1ATOMS65=23,78the atoms involved in each of the contacts you wish to calculateSWITCH65={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5802386999130249}The switching functions to use for each of the contacts in your mapWEIGHT65=0.001272264631043257A weight value for a given contact, by default is 1ATOMS66=23,90the atoms involved in each of the contacts you wish to calculateSWITCH66={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5899050235748291}The switching functions to use for each of the contacts in your mapWEIGHT66=0.001272264631043257A weight value for a given contact, by default is 1ATOMS67=23,92the atoms involved in each of the contacts you wish to calculateSWITCH67={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5753910541534424}The switching functions to use for each of the contacts in your mapWEIGHT67=0.001272264631043257A weight value for a given contact, by default is 1ATOMS68=23,2608the atoms involved in each of the contacts you wish to calculateSWITCH68={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5386306047439575}The switching functions to use for each of the contacts in your mapWEIGHT68=0.001272264631043257A weight value for a given contact, by default is 1ATOMS69=23,2614the atoms involved in each of the contacts you wish to calculateSWITCH69={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5421199202537537}The switching functions to use for each of the contacts in your mapWEIGHT69=0.001272264631043257A weight value for a given contact, by default is 1ATOMS70=23,2620the atoms involved in each of the contacts you wish to calculateSWITCH70={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5734334588050842}The switching functions to use for each of the contacts in your mapWEIGHT70=0.001272264631043257A weight value for a given contact, by default is 1ATOMS71=23,2672the atoms involved in each of the contacts you wish to calculateSWITCH71={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48766884207725525}The switching functions to use for each of the contacts in your mapWEIGHT71=0.001272264631043257A weight value for a given contact, by default is 1ATOMS72=23,2675the atoms involved in each of the contacts you wish to calculateSWITCH72={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.36144986748695374}The switching functions to use for each of the contacts in your mapWEIGHT72=0.001272264631043257A weight value for a given contact, by default is 1ATOMS73=23,2678the atoms involved in each of the contacts you wish to calculateSWITCH73={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3718279302120209}The switching functions to use for each of the contacts in your mapWEIGHT73=0.001272264631043257A weight value for a given contact, by default is 1ATOMS74=23,2679the atoms involved in each of the contacts you wish to calculateSWITCH74={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.34128299355506897}The switching functions to use for each of the contacts in your mapWEIGHT74=0.001272264631043257A weight value for a given contact, by default is 1ATOMS75=23,2680the atoms involved in each of the contacts you wish to calculateSWITCH75={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.47510942816734314}The switching functions to use for each of the contacts in your mapWEIGHT75=0.001272264631043257A weight value for a given contact, by default is 1ATOMS76=24,71the atoms involved in each of the contacts you wish to calculateSWITCH76={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.2877117693424225}The switching functions to use for each of the contacts in your mapWEIGHT76=0.001272264631043257A weight value for a given contact, by default is 1ATOMS77=24,73the atoms involved in each of the contacts you wish to calculateSWITCH77={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.36704790592193604}The switching functions to use for each of the contacts in your mapWEIGHT77=0.001272264631043257A weight value for a given contact, by default is 1ATOMS78=24,75the atoms involved in each of the contacts you wish to calculateSWITCH78={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.33189159631729126}The switching functions to use for each of the contacts in your mapWEIGHT78=0.001272264631043257A weight value for a given contact, by default is 1ATOMS79=24,78the atoms involved in each of the contacts you wish to calculateSWITCH79={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.47225090861320496}The switching functions to use for each of the contacts in your mapWEIGHT79=0.001272264631043257A weight value for a given contact, by default is 1ATOMS80=24,79the atoms involved in each of the contacts you wish to calculateSWITCH80={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5406902432441711}The switching functions to use for each of the contacts in your mapWEIGHT80=0.001272264631043257A weight value for a given contact, by default is 1ATOMS81=24,86the atoms involved in each of the contacts you wish to calculateSWITCH81={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.562769889831543}The switching functions to use for each of the contacts in your mapWEIGHT81=0.001272264631043257A weight value for a given contact, by default is 1ATOMS82=24,90the atoms involved in each of the contacts you wish to calculateSWITCH82={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.481701135635376}The switching functions to use for each of the contacts in your mapWEIGHT82=0.001272264631043257A weight value for a given contact, by default is 1ATOMS83=24,91the atoms involved in each of the contacts you wish to calculateSWITCH83={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5948319435119629}The switching functions to use for each of the contacts in your mapWEIGHT83=0.001272264631043257A weight value for a given contact, by default is 1ATOMS84=24,92the atoms involved in each of the contacts you wish to calculateSWITCH84={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4847874641418457}The switching functions to use for each of the contacts in your mapWEIGHT84=0.001272264631043257A weight value for a given contact, by default is 1ATOMS85=24,2608the atoms involved in each of the contacts you wish to calculateSWITCH85={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5351438522338867}The switching functions to use for each of the contacts in your mapWEIGHT85=0.001272264631043257A weight value for a given contact, by default is 1ATOMS86=24,2614the atoms involved in each of the contacts you wish to calculateSWITCH86={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5863667726516724}The switching functions to use for each of the contacts in your mapWEIGHT86=0.001272264631043257A weight value for a given contact, by default is 1ATOMS87=24,2619the atoms involved in each of the contacts you wish to calculateSWITCH87={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5716545581817627}The switching functions to use for each of the contacts in your mapWEIGHT87=0.001272264631043257A weight value for a given contact, by default is 1ATOMS88=24,2620the atoms involved in each of the contacts you wish to calculateSWITCH88={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5403016209602356}The switching functions to use for each of the contacts in your mapWEIGHT88=0.001272264631043257A weight value for a given contact, by default is 1ATOMS89=24,2621the atoms involved in each of the contacts you wish to calculateSWITCH89={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5933851599693298}The switching functions to use for each of the contacts in your mapWEIGHT89=0.001272264631043257A weight value for a given contact, by default is 1ATOMS90=24,2623the atoms involved in each of the contacts you wish to calculateSWITCH90={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5734788179397583}The switching functions to use for each of the contacts in your mapWEIGHT90=0.001272264631043257A weight value for a given contact, by default is 1ATOMS91=24,2627the atoms involved in each of the contacts you wish to calculateSWITCH91={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5404683947563171}The switching functions to use for each of the contacts in your mapWEIGHT91=0.001272264631043257A weight value for a given contact, by default is 1ATOMS92=24,2670the atoms involved in each of the contacts you wish to calculateSWITCH92={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5716544985771179}The switching functions to use for each of the contacts in your mapWEIGHT92=0.001272264631043257A weight value for a given contact, by default is 1ATOMS93=24,2672the atoms involved in each of the contacts you wish to calculateSWITCH93={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4304285943508148}The switching functions to use for each of the contacts in your mapWEIGHT93=0.001272264631043257A weight value for a given contact, by default is 1ATOMS94=24,2675the atoms involved in each of the contacts you wish to calculateSWITCH94={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3302513062953949}The switching functions to use for each of the contacts in your mapWEIGHT94=0.001272264631043257A weight value for a given contact, by default is 1ATOMS95=24,2678the atoms involved in each of the contacts you wish to calculateSWITCH95={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3791040778160095}The switching functions to use for each of the contacts in your mapWEIGHT95=0.001272264631043257A weight value for a given contact, by default is 1ATOMS96=24,2679the atoms involved in each of the contacts you wish to calculateSWITCH96={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.38755902647972107}The switching functions to use for each of the contacts in your mapWEIGHT96=0.001272264631043257A weight value for a given contact, by default is 1ATOMS97=24,2680the atoms involved in each of the contacts you wish to calculateSWITCH97={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4711739122867584}The switching functions to use for each of the contacts in your mapWEIGHT97=0.001272264631043257A weight value for a given contact, by default is 1ATOMS98=25,92the atoms involved in each of the contacts you wish to calculateSWITCH98={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.593320369720459}The switching functions to use for each of the contacts in your mapWEIGHT98=0.001272264631043257A weight value for a given contact, by default is 1ATOMS99=25,2672the atoms involved in each of the contacts you wish to calculateSWITCH99={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5299820303916931}The switching functions to use for each of the contacts in your mapWEIGHT99=0.001272264631043257A weight value for a given contact, by default is 1ATOMS100=25,2675the atoms involved in each of the contacts you wish to calculateSWITCH100={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.40893274545669556}The switching functions to use for each of the contacts in your mapWEIGHT100=0.001272264631043257A weight value for a given contact, by default is 1ATOMS101=25,2678the atoms involved in each of the contacts you wish to calculateSWITCH101={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3681331276893616}The switching functions to use for each of the contacts in your mapWEIGHT101=0.001272264631043257A weight value for a given contact, by default is 1ATOMS102=25,2679the atoms involved in each of the contacts you wish to calculateSWITCH102={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.32019057869911194}The switching functions to use for each of the contacts in your mapWEIGHT102=0.001272264631043257A weight value for a given contact, by default is 1ATOMS103=25,2680the atoms involved in each of the contacts you wish to calculateSWITCH103={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44893988966941833}The switching functions to use for each of the contacts in your mapWEIGHT103=0.001272264631043257A weight value for a given contact, by default is 1ATOMS104=27,92the atoms involved in each of the contacts you wish to calculateSWITCH104={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.510956883430481}The switching functions to use for each of the contacts in your mapWEIGHT104=0.001272264631043257A weight value for a given contact, by default is 1ATOMS105=27,96the atoms involved in each of the contacts you wish to calculateSWITCH105={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.584258496761322}The switching functions to use for each of the contacts in your mapWEIGHT105=0.001272264631043257A weight value for a given contact, by default is 1ATOMS106=27,99the atoms involved in each of the contacts you wish to calculateSWITCH106={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49235567450523376}The switching functions to use for each of the contacts in your mapWEIGHT106=0.001272264631043257A weight value for a given contact, by default is 1ATOMS107=27,102the atoms involved in each of the contacts you wish to calculateSWITCH107={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5754112601280212}The switching functions to use for each of the contacts in your mapWEIGHT107=0.001272264631043257A weight value for a given contact, by default is 1ATOMS108=27,2672the atoms involved in each of the contacts you wish to calculateSWITCH108={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5144948363304138}The switching functions to use for each of the contacts in your mapWEIGHT108=0.001272264631043257A weight value for a given contact, by default is 1ATOMS109=27,2675the atoms involved in each of the contacts you wish to calculateSWITCH109={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.42616894841194153}The switching functions to use for each of the contacts in your mapWEIGHT109=0.001272264631043257A weight value for a given contact, by default is 1ATOMS110=27,2678the atoms involved in each of the contacts you wish to calculateSWITCH110={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.37256675958633423}The switching functions to use for each of the contacts in your mapWEIGHT110=0.001272264631043257A weight value for a given contact, by default is 1ATOMS111=27,2679the atoms involved in each of the contacts you wish to calculateSWITCH111={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3573150038719177}The switching functions to use for each of the contacts in your mapWEIGHT111=0.001272264631043257A weight value for a given contact, by default is 1ATOMS112=27,2680the atoms involved in each of the contacts you wish to calculateSWITCH112={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.41182634234428406}The switching functions to use for each of the contacts in your mapWEIGHT112=0.001272264631043257A weight value for a given contact, by default is 1ATOMS113=27,2757the atoms involved in each of the contacts you wish to calculateSWITCH113={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5834671854972839}The switching functions to use for each of the contacts in your mapWEIGHT113=0.001272264631043257A weight value for a given contact, by default is 1ATOMS114=27,2760the atoms involved in each of the contacts you wish to calculateSWITCH114={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5841530561447144}The switching functions to use for each of the contacts in your mapWEIGHT114=0.001272264631043257A weight value for a given contact, by default is 1ATOMS115=29,99the atoms involved in each of the contacts you wish to calculateSWITCH115={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.514694094657898}The switching functions to use for each of the contacts in your mapWEIGHT115=0.001272264631043257A weight value for a given contact, by default is 1ATOMS116=29,102the atoms involved in each of the contacts you wish to calculateSWITCH116={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5818952322006226}The switching functions to use for each of the contacts in your mapWEIGHT116=0.001272264631043257A weight value for a given contact, by default is 1ATOMS117=29,2675the atoms involved in each of the contacts you wish to calculateSWITCH117={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5233622789382935}The switching functions to use for each of the contacts in your mapWEIGHT117=0.001272264631043257A weight value for a given contact, by default is 1ATOMS118=29,2678the atoms involved in each of the contacts you wish to calculateSWITCH118={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.42942535877227783}The switching functions to use for each of the contacts in your mapWEIGHT118=0.001272264631043257A weight value for a given contact, by default is 1ATOMS119=29,2679the atoms involved in each of the contacts you wish to calculateSWITCH119={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.39814838767051697}The switching functions to use for each of the contacts in your mapWEIGHT119=0.001272264631043257A weight value for a given contact, by default is 1ATOMS120=29,2680the atoms involved in each of the contacts you wish to calculateSWITCH120={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4375673234462738}The switching functions to use for each of the contacts in your mapWEIGHT120=0.001272264631043257A weight value for a given contact, by default is 1ATOMS121=29,2757the atoms involved in each of the contacts you wish to calculateSWITCH121={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5820671916007996}The switching functions to use for each of the contacts in your mapWEIGHT121=0.001272264631043257A weight value for a given contact, by default is 1ATOMS122=29,2760the atoms involved in each of the contacts you wish to calculateSWITCH122={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5739086270332336}The switching functions to use for each of the contacts in your mapWEIGHT122=0.001272264631043257A weight value for a given contact, by default is 1ATOMS123=32,92the atoms involved in each of the contacts you wish to calculateSWITCH123={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.590475857257843}The switching functions to use for each of the contacts in your mapWEIGHT123=0.001272264631043257A weight value for a given contact, by default is 1ATOMS124=32,96the atoms involved in each of the contacts you wish to calculateSWITCH124={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5980925559997559}The switching functions to use for each of the contacts in your mapWEIGHT124=0.001272264631043257A weight value for a given contact, by default is 1ATOMS125=32,99the atoms involved in each of the contacts you wish to calculateSWITCH125={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4611669182777405}The switching functions to use for each of the contacts in your mapWEIGHT125=0.001272264631043257A weight value for a given contact, by default is 1ATOMS126=32,102the atoms involved in each of the contacts you wish to calculateSWITCH126={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.490816593170166}The switching functions to use for each of the contacts in your mapWEIGHT126=0.001272264631043257A weight value for a given contact, by default is 1ATOMS127=32,103the atoms involved in each of the contacts you wish to calculateSWITCH127={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5402840971946716}The switching functions to use for each of the contacts in your mapWEIGHT127=0.001272264631043257A weight value for a given contact, by default is 1ATOMS128=32,104the atoms involved in each of the contacts you wish to calculateSWITCH128={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5118651390075684}The switching functions to use for each of the contacts in your mapWEIGHT128=0.001272264631043257A weight value for a given contact, by default is 1ATOMS129=32,2672the atoms involved in each of the contacts you wish to calculateSWITCH129={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.59260094165802}The switching functions to use for each of the contacts in your mapWEIGHT129=0.001272264631043257A weight value for a given contact, by default is 1ATOMS130=32,2675the atoms involved in each of the contacts you wish to calculateSWITCH130={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5480044484138489}The switching functions to use for each of the contacts in your mapWEIGHT130=0.001272264631043257A weight value for a given contact, by default is 1ATOMS131=32,2678the atoms involved in each of the contacts you wish to calculateSWITCH131={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.45117735862731934}The switching functions to use for each of the contacts in your mapWEIGHT131=0.001272264631043257A weight value for a given contact, by default is 1ATOMS132=32,2679the atoms involved in each of the contacts you wish to calculateSWITCH132={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4540870189666748}The switching functions to use for each of the contacts in your mapWEIGHT132=0.001272264631043257A weight value for a given contact, by default is 1ATOMS133=32,2680the atoms involved in each of the contacts you wish to calculateSWITCH133={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4137559235095978}The switching functions to use for each of the contacts in your mapWEIGHT133=0.001272264631043257A weight value for a given contact, by default is 1ATOMS134=32,2757the atoms involved in each of the contacts you wish to calculateSWITCH134={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4610433578491211}The switching functions to use for each of the contacts in your mapWEIGHT134=0.001272264631043257A weight value for a given contact, by default is 1ATOMS135=32,2760the atoms involved in each of the contacts you wish to calculateSWITCH135={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4710689187049866}The switching functions to use for each of the contacts in your mapWEIGHT135=0.001272264631043257A weight value for a given contact, by default is 1ATOMS136=33,92the atoms involved in each of the contacts you wish to calculateSWITCH136={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48619014024734497}The switching functions to use for each of the contacts in your mapWEIGHT136=0.001272264631043257A weight value for a given contact, by default is 1ATOMS137=33,94the atoms involved in each of the contacts you wish to calculateSWITCH137={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5412965416908264}The switching functions to use for each of the contacts in your mapWEIGHT137=0.001272264631043257A weight value for a given contact, by default is 1ATOMS138=33,96the atoms involved in each of the contacts you wish to calculateSWITCH138={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5099625587463379}The switching functions to use for each of the contacts in your mapWEIGHT138=0.001272264631043257A weight value for a given contact, by default is 1ATOMS139=33,99the atoms involved in each of the contacts you wish to calculateSWITCH139={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.37818774580955505}The switching functions to use for each of the contacts in your mapWEIGHT139=0.001272264631043257A weight value for a given contact, by default is 1ATOMS140=33,102the atoms involved in each of the contacts you wish to calculateSWITCH140={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.39580798149108887}The switching functions to use for each of the contacts in your mapWEIGHT140=0.001272264631043257A weight value for a given contact, by default is 1ATOMS141=33,103the atoms involved in each of the contacts you wish to calculateSWITCH141={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4280443787574768}The switching functions to use for each of the contacts in your mapWEIGHT141=0.001272264631043257A weight value for a given contact, by default is 1ATOMS142=33,104the atoms involved in each of the contacts you wish to calculateSWITCH142={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.436663419008255}The switching functions to use for each of the contacts in your mapWEIGHT142=0.001272264631043257A weight value for a given contact, by default is 1ATOMS143=33,2672the atoms involved in each of the contacts you wish to calculateSWITCH143={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5442655682563782}The switching functions to use for each of the contacts in your mapWEIGHT143=0.001272264631043257A weight value for a given contact, by default is 1ATOMS144=33,2675the atoms involved in each of the contacts you wish to calculateSWITCH144={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5237347483634949}The switching functions to use for each of the contacts in your mapWEIGHT144=0.001272264631043257A weight value for a given contact, by default is 1ATOMS145=33,2678the atoms involved in each of the contacts you wish to calculateSWITCH145={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.45534396171569824}The switching functions to use for each of the contacts in your mapWEIGHT145=0.001272264631043257A weight value for a given contact, by default is 1ATOMS146=33,2679the atoms involved in each of the contacts you wish to calculateSWITCH146={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4873952567577362}The switching functions to use for each of the contacts in your mapWEIGHT146=0.001272264631043257A weight value for a given contact, by default is 1ATOMS147=33,2680the atoms involved in each of the contacts you wish to calculateSWITCH147={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.41103172302246094}The switching functions to use for each of the contacts in your mapWEIGHT147=0.001272264631043257A weight value for a given contact, by default is 1ATOMS148=33,2754the atoms involved in each of the contacts you wish to calculateSWITCH148={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5307222604751587}The switching functions to use for each of the contacts in your mapWEIGHT148=0.001272264631043257A weight value for a given contact, by default is 1ATOMS149=33,2757the atoms involved in each of the contacts you wish to calculateSWITCH149={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.39317935705184937}The switching functions to use for each of the contacts in your mapWEIGHT149=0.001272264631043257A weight value for a given contact, by default is 1ATOMS150=33,2760the atoms involved in each of the contacts you wish to calculateSWITCH150={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4363679587841034}The switching functions to use for each of the contacts in your mapWEIGHT150=0.001272264631043257A weight value for a given contact, by default is 1ATOMS151=34,99the atoms involved in each of the contacts you wish to calculateSWITCH151={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5410417914390564}The switching functions to use for each of the contacts in your mapWEIGHT151=0.001272264631043257A weight value for a given contact, by default is 1ATOMS152=34,102the atoms involved in each of the contacts you wish to calculateSWITCH152={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5479307770729065}The switching functions to use for each of the contacts in your mapWEIGHT152=0.001272264631043257A weight value for a given contact, by default is 1ATOMS153=34,104the atoms involved in each of the contacts you wish to calculateSWITCH153={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5418220162391663}The switching functions to use for each of the contacts in your mapWEIGHT153=0.001272264631043257A weight value for a given contact, by default is 1ATOMS154=34,2678the atoms involved in each of the contacts you wish to calculateSWITCH154={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5124003291130066}The switching functions to use for each of the contacts in your mapWEIGHT154=0.001272264631043257A weight value for a given contact, by default is 1ATOMS155=34,2679the atoms involved in each of the contacts you wish to calculateSWITCH155={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5096724629402161}The switching functions to use for each of the contacts in your mapWEIGHT155=0.001272264631043257A weight value for a given contact, by default is 1ATOMS156=34,2680the atoms involved in each of the contacts you wish to calculateSWITCH156={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4535317122936249}The switching functions to use for each of the contacts in your mapWEIGHT156=0.001272264631043257A weight value for a given contact, by default is 1ATOMS157=34,2757the atoms involved in each of the contacts you wish to calculateSWITCH157={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.47039350867271423}The switching functions to use for each of the contacts in your mapWEIGHT157=0.001272264631043257A weight value for a given contact, by default is 1ATOMS158=34,2760the atoms involved in each of the contacts you wish to calculateSWITCH158={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.46715834736824036}The switching functions to use for each of the contacts in your mapWEIGHT158=0.001272264631043257A weight value for a given contact, by default is 1ATOMS159=35,92the atoms involved in each of the contacts you wish to calculateSWITCH159={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4022260308265686}The switching functions to use for each of the contacts in your mapWEIGHT159=0.001272264631043257A weight value for a given contact, by default is 1ATOMS160=35,94the atoms involved in each of the contacts you wish to calculateSWITCH160={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4914253354072571}The switching functions to use for each of the contacts in your mapWEIGHT160=0.001272264631043257A weight value for a given contact, by default is 1ATOMS161=35,96the atoms involved in each of the contacts you wish to calculateSWITCH161={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4575159251689911}The switching functions to use for each of the contacts in your mapWEIGHT161=0.001272264631043257A weight value for a given contact, by default is 1ATOMS162=35,99the atoms involved in each of the contacts you wish to calculateSWITCH162={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.38637933135032654}The switching functions to use for each of the contacts in your mapWEIGHT162=0.001272264631043257A weight value for a given contact, by default is 1ATOMS163=35,102the atoms involved in each of the contacts you wish to calculateSWITCH163={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4969920217990875}The switching functions to use for each of the contacts in your mapWEIGHT163=0.001272264631043257A weight value for a given contact, by default is 1ATOMS164=35,103the atoms involved in each of the contacts you wish to calculateSWITCH164={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5403600931167603}The switching functions to use for each of the contacts in your mapWEIGHT164=0.001272264631043257A weight value for a given contact, by default is 1ATOMS165=35,104the atoms involved in each of the contacts you wish to calculateSWITCH165={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5723757147789001}The switching functions to use for each of the contacts in your mapWEIGHT165=0.001272264631043257A weight value for a given contact, by default is 1ATOMS166=35,105the atoms involved in each of the contacts you wish to calculateSWITCH166={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5979505181312561}The switching functions to use for each of the contacts in your mapWEIGHT166=0.001272264631043257A weight value for a given contact, by default is 1ATOMS167=35,107the atoms involved in each of the contacts you wish to calculateSWITCH167={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5827502012252808}The switching functions to use for each of the contacts in your mapWEIGHT167=0.001272264631043257A weight value for a given contact, by default is 1ATOMS168=35,2672the atoms involved in each of the contacts you wish to calculateSWITCH168={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5985766053199768}The switching functions to use for each of the contacts in your mapWEIGHT168=0.001272264631043257A weight value for a given contact, by default is 1ATOMS169=35,2675the atoms involved in each of the contacts you wish to calculateSWITCH169={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5248190760612488}The switching functions to use for each of the contacts in your mapWEIGHT169=0.001272264631043257A weight value for a given contact, by default is 1ATOMS170=35,2678the atoms involved in each of the contacts you wish to calculateSWITCH170={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5012356638908386}The switching functions to use for each of the contacts in your mapWEIGHT170=0.001272264631043257A weight value for a given contact, by default is 1ATOMS171=35,2679the atoms involved in each of the contacts you wish to calculateSWITCH171={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4978325366973877}The switching functions to use for each of the contacts in your mapWEIGHT171=0.001272264631043257A weight value for a given contact, by default is 1ATOMS172=35,2680the atoms involved in each of the contacts you wish to calculateSWITCH172={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5375557541847229}The switching functions to use for each of the contacts in your mapWEIGHT172=0.001272264631043257A weight value for a given contact, by default is 1ATOMS173=36,92the atoms involved in each of the contacts you wish to calculateSWITCH173={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.2943228483200073}The switching functions to use for each of the contacts in your mapWEIGHT173=0.001272264631043257A weight value for a given contact, by default is 1ATOMS174=36,94the atoms involved in each of the contacts you wish to calculateSWITCH174={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3750133216381073}The switching functions to use for each of the contacts in your mapWEIGHT174=0.001272264631043257A weight value for a given contact, by default is 1ATOMS175=36,96the atoms involved in each of the contacts you wish to calculateSWITCH175={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.34881076216697693}The switching functions to use for each of the contacts in your mapWEIGHT175=0.001272264631043257A weight value for a given contact, by default is 1ATOMS176=36,99the atoms involved in each of the contacts you wish to calculateSWITCH176={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.2804799973964691}The switching functions to use for each of the contacts in your mapWEIGHT176=0.001272264631043257A weight value for a given contact, by default is 1ATOMS177=36,102the atoms involved in each of the contacts you wish to calculateSWITCH177={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3877641260623932}The switching functions to use for each of the contacts in your mapWEIGHT177=0.001272264631043257A weight value for a given contact, by default is 1ATOMS178=36,103the atoms involved in each of the contacts you wish to calculateSWITCH178={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4228392243385315}The switching functions to use for each of the contacts in your mapWEIGHT178=0.001272264631043257A weight value for a given contact, by default is 1ATOMS179=36,104the atoms involved in each of the contacts you wish to calculateSWITCH179={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4766486585140228}The switching functions to use for each of the contacts in your mapWEIGHT179=0.001272264631043257A weight value for a given contact, by default is 1ATOMS180=36,105the atoms involved in each of the contacts you wish to calculateSWITCH180={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4921880066394806}The switching functions to use for each of the contacts in your mapWEIGHT180=0.001272264631043257A weight value for a given contact, by default is 1ATOMS181=36,107the atoms involved in each of the contacts you wish to calculateSWITCH181={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4955866038799286}The switching functions to use for each of the contacts in your mapWEIGHT181=0.001272264631043257A weight value for a given contact, by default is 1ATOMS182=36,2675the atoms involved in each of the contacts you wish to calculateSWITCH182={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5572888851165771}The switching functions to use for each of the contacts in your mapWEIGHT182=0.001272264631043257A weight value for a given contact, by default is 1ATOMS183=36,2678the atoms involved in each of the contacts you wish to calculateSWITCH183={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5471096634864807}The switching functions to use for each of the contacts in your mapWEIGHT183=0.001272264631043257A weight value for a given contact, by default is 1ATOMS184=36,2679the atoms involved in each of the contacts you wish to calculateSWITCH184={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.568331778049469}The switching functions to use for each of the contacts in your mapWEIGHT184=0.001272264631043257A weight value for a given contact, by default is 1ATOMS185=36,2680the atoms involved in each of the contacts you wish to calculateSWITCH185={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5628942251205444}The switching functions to use for each of the contacts in your mapWEIGHT185=0.001272264631043257A weight value for a given contact, by default is 1ATOMS186=36,2757the atoms involved in each of the contacts you wish to calculateSWITCH186={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5997772216796875}The switching functions to use for each of the contacts in your mapWEIGHT186=0.001272264631043257A weight value for a given contact, by default is 1ATOMS187=37,107the atoms involved in each of the contacts you wish to calculateSWITCH187={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5903169512748718}The switching functions to use for each of the contacts in your mapWEIGHT187=0.001272264631043257A weight value for a given contact, by default is 1ATOMS188=37,2678the atoms involved in each of the contacts you wish to calculateSWITCH188={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5944754481315613}The switching functions to use for each of the contacts in your mapWEIGHT188=0.001272264631043257A weight value for a given contact, by default is 1ATOMS189=37,2679the atoms involved in each of the contacts you wish to calculateSWITCH189={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5704463720321655}The switching functions to use for each of the contacts in your mapWEIGHT189=0.001272264631043257A weight value for a given contact, by default is 1ATOMS190=39,107the atoms involved in each of the contacts you wish to calculateSWITCH190={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5027105808258057}The switching functions to use for each of the contacts in your mapWEIGHT190=0.001272264631043257A weight value for a given contact, by default is 1ATOMS191=39,109the atoms involved in each of the contacts you wish to calculateSWITCH191={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5935462713241577}The switching functions to use for each of the contacts in your mapWEIGHT191=0.001272264631043257A weight value for a given contact, by default is 1ATOMS192=39,111the atoms involved in each of the contacts you wish to calculateSWITCH192={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5568773746490479}The switching functions to use for each of the contacts in your mapWEIGHT192=0.001272264631043257A weight value for a given contact, by default is 1ATOMS193=50,107the atoms involved in each of the contacts you wish to calculateSWITCH193={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4006657898426056}The switching functions to use for each of the contacts in your mapWEIGHT193=0.001272264631043257A weight value for a given contact, by default is 1ATOMS194=50,109the atoms involved in each of the contacts you wish to calculateSWITCH194={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4821600615978241}The switching functions to use for each of the contacts in your mapWEIGHT194=0.001272264631043257A weight value for a given contact, by default is 1ATOMS195=50,111the atoms involved in each of the contacts you wish to calculateSWITCH195={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4323927164077759}The switching functions to use for each of the contacts in your mapWEIGHT195=0.001272264631043257A weight value for a given contact, by default is 1ATOMS196=50,114the atoms involved in each of the contacts you wish to calculateSWITCH196={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5512949228286743}The switching functions to use for each of the contacts in your mapWEIGHT196=0.001272264631043257A weight value for a given contact, by default is 1ATOMS197=50,116the atoms involved in each of the contacts you wish to calculateSWITCH197={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5583664774894714}The switching functions to use for each of the contacts in your mapWEIGHT197=0.001272264631043257A weight value for a given contact, by default is 1ATOMS198=50,117the atoms involved in each of the contacts you wish to calculateSWITCH198={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5980715155601501}The switching functions to use for each of the contacts in your mapWEIGHT198=0.001272264631043257A weight value for a given contact, by default is 1ATOMS199=50,119the atoms involved in each of the contacts you wish to calculateSWITCH199={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5966382622718811}The switching functions to use for each of the contacts in your mapWEIGHT199=0.001272264631043257A weight value for a given contact, by default is 1ATOMS200=51,107the atoms involved in each of the contacts you wish to calculateSWITCH200={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.2862236797809601}The switching functions to use for each of the contacts in your mapWEIGHT200=0.001272264631043257A weight value for a given contact, by default is 1ATOMS201=51,109the atoms involved in each of the contacts you wish to calculateSWITCH201={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3626832962036133}The switching functions to use for each of the contacts in your mapWEIGHT201=0.001272264631043257A weight value for a given contact, by default is 1ATOMS202=51,111the atoms involved in each of the contacts you wish to calculateSWITCH202={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.32580095529556274}The switching functions to use for each of the contacts in your mapWEIGHT202=0.001272264631043257A weight value for a given contact, by default is 1ATOMS203=51,114the atoms involved in each of the contacts you wish to calculateSWITCH203={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4501654803752899}The switching functions to use for each of the contacts in your mapWEIGHT203=0.001272264631043257A weight value for a given contact, by default is 1ATOMS204=51,115the atoms involved in each of the contacts you wish to calculateSWITCH204={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5505958199501038}The switching functions to use for each of the contacts in your mapWEIGHT204=0.001272264631043257A weight value for a given contact, by default is 1ATOMS205=51,116the atoms involved in each of the contacts you wish to calculateSWITCH205={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4751568138599396}The switching functions to use for each of the contacts in your mapWEIGHT205=0.001272264631043257A weight value for a given contact, by default is 1ATOMS206=51,117the atoms involved in each of the contacts you wish to calculateSWITCH206={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48598387837409973}The switching functions to use for each of the contacts in your mapWEIGHT206=0.001272264631043257A weight value for a given contact, by default is 1ATOMS207=51,118the atoms involved in each of the contacts you wish to calculateSWITCH207={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5959718823432922}The switching functions to use for each of the contacts in your mapWEIGHT207=0.001272264631043257A weight value for a given contact, by default is 1ATOMS208=51,119the atoms involved in each of the contacts you wish to calculateSWITCH208={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5002760291099548}The switching functions to use for each of the contacts in your mapWEIGHT208=0.001272264631043257A weight value for a given contact, by default is 1ATOMS209=54,119the atoms involved in each of the contacts you wish to calculateSWITCH209={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.527902364730835}The switching functions to use for each of the contacts in your mapWEIGHT209=0.001272264631043257A weight value for a given contact, by default is 1ATOMS210=54,2489the atoms involved in each of the contacts you wish to calculateSWITCH210={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.553002655506134}The switching functions to use for each of the contacts in your mapWEIGHT210=0.001272264631043257A weight value for a given contact, by default is 1ATOMS211=54,2491the atoms involved in each of the contacts you wish to calculateSWITCH211={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5405457019805908}The switching functions to use for each of the contacts in your mapWEIGHT211=0.001272264631043257A weight value for a given contact, by default is 1ATOMS212=54,2493the atoms involved in each of the contacts you wish to calculateSWITCH212={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4647645950317383}The switching functions to use for each of the contacts in your mapWEIGHT212=0.001272264631043257A weight value for a given contact, by default is 1ATOMS213=54,2565the atoms involved in each of the contacts you wish to calculateSWITCH213={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5805972218513489}The switching functions to use for each of the contacts in your mapWEIGHT213=0.001272264631043257A weight value for a given contact, by default is 1ATOMS214=54,2627the atoms involved in each of the contacts you wish to calculateSWITCH214={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.537663459777832}The switching functions to use for each of the contacts in your mapWEIGHT214=0.001272264631043257A weight value for a given contact, by default is 1ATOMS215=56,2489the atoms involved in each of the contacts you wish to calculateSWITCH215={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5900083184242249}The switching functions to use for each of the contacts in your mapWEIGHT215=0.001272264631043257A weight value for a given contact, by default is 1ATOMS216=56,2491the atoms involved in each of the contacts you wish to calculateSWITCH216={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5195974111557007}The switching functions to use for each of the contacts in your mapWEIGHT216=0.001272264631043257A weight value for a given contact, by default is 1ATOMS217=56,2493the atoms involved in each of the contacts you wish to calculateSWITCH217={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.47877347469329834}The switching functions to use for each of the contacts in your mapWEIGHT217=0.001272264631043257A weight value for a given contact, by default is 1ATOMS218=56,2556the atoms involved in each of the contacts you wish to calculateSWITCH218={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5279479622840881}The switching functions to use for each of the contacts in your mapWEIGHT218=0.001272264631043257A weight value for a given contact, by default is 1ATOMS219=56,2558the atoms involved in each of the contacts you wish to calculateSWITCH219={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5092247724533081}The switching functions to use for each of the contacts in your mapWEIGHT219=0.001272264631043257A weight value for a given contact, by default is 1ATOMS220=56,2561the atoms involved in each of the contacts you wish to calculateSWITCH220={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.561905562877655}The switching functions to use for each of the contacts in your mapWEIGHT220=0.001272264631043257A weight value for a given contact, by default is 1ATOMS221=56,2562the atoms involved in each of the contacts you wish to calculateSWITCH221={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5512357354164124}The switching functions to use for each of the contacts in your mapWEIGHT221=0.001272264631043257A weight value for a given contact, by default is 1ATOMS222=56,2564the atoms involved in each of the contacts you wish to calculateSWITCH222={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5136593580245972}The switching functions to use for each of the contacts in your mapWEIGHT222=0.001272264631043257A weight value for a given contact, by default is 1ATOMS223=56,2565the atoms involved in each of the contacts you wish to calculateSWITCH223={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.43993300199508667}The switching functions to use for each of the contacts in your mapWEIGHT223=0.001272264631043257A weight value for a given contact, by default is 1ATOMS224=56,2608the atoms involved in each of the contacts you wish to calculateSWITCH224={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5183058381080627}The switching functions to use for each of the contacts in your mapWEIGHT224=0.001272264631043257A weight value for a given contact, by default is 1ATOMS225=56,2611the atoms involved in each of the contacts you wish to calculateSWITCH225={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5881958603858948}The switching functions to use for each of the contacts in your mapWEIGHT225=0.001272264631043257A weight value for a given contact, by default is 1ATOMS226=56,2614the atoms involved in each of the contacts you wish to calculateSWITCH226={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5355895161628723}The switching functions to use for each of the contacts in your mapWEIGHT226=0.001272264631043257A weight value for a given contact, by default is 1ATOMS227=56,2621the atoms involved in each of the contacts you wish to calculateSWITCH227={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5849206447601318}The switching functions to use for each of the contacts in your mapWEIGHT227=0.001272264631043257A weight value for a given contact, by default is 1ATOMS228=56,2625the atoms involved in each of the contacts you wish to calculateSWITCH228={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5958532691001892}The switching functions to use for each of the contacts in your mapWEIGHT228=0.001272264631043257A weight value for a given contact, by default is 1ATOMS229=56,2627the atoms involved in each of the contacts you wish to calculateSWITCH229={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.458141952753067}The switching functions to use for each of the contacts in your mapWEIGHT229=0.001272264631043257A weight value for a given contact, by default is 1ATOMS230=58,119the atoms involved in each of the contacts you wish to calculateSWITCH230={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5716099739074707}The switching functions to use for each of the contacts in your mapWEIGHT230=0.001272264631043257A weight value for a given contact, by default is 1ATOMS231=58,123the atoms involved in each of the contacts you wish to calculateSWITCH231={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5633655190467834}The switching functions to use for each of the contacts in your mapWEIGHT231=0.001272264631043257A weight value for a given contact, by default is 1ATOMS232=58,2481the atoms involved in each of the contacts you wish to calculateSWITCH232={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5999452471733093}The switching functions to use for each of the contacts in your mapWEIGHT232=0.001272264631043257A weight value for a given contact, by default is 1ATOMS233=58,2484the atoms involved in each of the contacts you wish to calculateSWITCH233={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5256874561309814}The switching functions to use for each of the contacts in your mapWEIGHT233=0.001272264631043257A weight value for a given contact, by default is 1ATOMS234=58,2487the atoms involved in each of the contacts you wish to calculateSWITCH234={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5972052812576294}The switching functions to use for each of the contacts in your mapWEIGHT234=0.001272264631043257A weight value for a given contact, by default is 1ATOMS235=58,2489the atoms involved in each of the contacts you wish to calculateSWITCH235={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48624786734580994}The switching functions to use for each of the contacts in your mapWEIGHT235=0.001272264631043257A weight value for a given contact, by default is 1ATOMS236=58,2491the atoms involved in each of the contacts you wish to calculateSWITCH236={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3958696126937866}The switching functions to use for each of the contacts in your mapWEIGHT236=0.001272264631043257A weight value for a given contact, by default is 1ATOMS237=58,2493the atoms involved in each of the contacts you wish to calculateSWITCH237={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3695770502090454}The switching functions to use for each of the contacts in your mapWEIGHT237=0.001272264631043257A weight value for a given contact, by default is 1ATOMS238=58,2556the atoms involved in each of the contacts you wish to calculateSWITCH238={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.45701441168785095}The switching functions to use for each of the contacts in your mapWEIGHT238=0.001272264631043257A weight value for a given contact, by default is 1ATOMS239=58,2558the atoms involved in each of the contacts you wish to calculateSWITCH239={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.424185186624527}The switching functions to use for each of the contacts in your mapWEIGHT239=0.001272264631043257A weight value for a given contact, by default is 1ATOMS240=58,2561the atoms involved in each of the contacts you wish to calculateSWITCH240={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5086857080459595}The switching functions to use for each of the contacts in your mapWEIGHT240=0.001272264631043257A weight value for a given contact, by default is 1ATOMS241=58,2562the atoms involved in each of the contacts you wish to calculateSWITCH241={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5307863354682922}The switching functions to use for each of the contacts in your mapWEIGHT241=0.001272264631043257A weight value for a given contact, by default is 1ATOMS242=58,2563the atoms involved in each of the contacts you wish to calculateSWITCH242={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5881573557853699}The switching functions to use for each of the contacts in your mapWEIGHT242=0.001272264631043257A weight value for a given contact, by default is 1ATOMS243=58,2564the atoms involved in each of the contacts you wish to calculateSWITCH243={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.42004892230033875}The switching functions to use for each of the contacts in your mapWEIGHT243=0.001272264631043257A weight value for a given contact, by default is 1ATOMS244=58,2565the atoms involved in each of the contacts you wish to calculateSWITCH244={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.35836589336395264}The switching functions to use for each of the contacts in your mapWEIGHT244=0.001272264631043257A weight value for a given contact, by default is 1ATOMS245=58,2566the atoms involved in each of the contacts you wish to calculateSWITCH245={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5086581110954285}The switching functions to use for each of the contacts in your mapWEIGHT245=0.001272264631043257A weight value for a given contact, by default is 1ATOMS246=58,2568the atoms involved in each of the contacts you wish to calculateSWITCH246={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.548278272151947}The switching functions to use for each of the contacts in your mapWEIGHT246=0.001272264631043257A weight value for a given contact, by default is 1ATOMS247=58,2579the atoms involved in each of the contacts you wish to calculateSWITCH247={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5944342613220215}The switching functions to use for each of the contacts in your mapWEIGHT247=0.001272264631043257A weight value for a given contact, by default is 1ATOMS248=58,2608the atoms involved in each of the contacts you wish to calculateSWITCH248={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5315127372741699}The switching functions to use for each of the contacts in your mapWEIGHT248=0.001272264631043257A weight value for a given contact, by default is 1ATOMS249=58,2614the atoms involved in each of the contacts you wish to calculateSWITCH249={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5951092839241028}The switching functions to use for each of the contacts in your mapWEIGHT249=0.001272264631043257A weight value for a given contact, by default is 1ATOMS250=58,2619the atoms involved in each of the contacts you wish to calculateSWITCH250={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.590059220790863}The switching functions to use for each of the contacts in your mapWEIGHT250=0.001272264631043257A weight value for a given contact, by default is 1ATOMS251=58,2621the atoms involved in each of the contacts you wish to calculateSWITCH251={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5361744165420532}The switching functions to use for each of the contacts in your mapWEIGHT251=0.001272264631043257A weight value for a given contact, by default is 1ATOMS252=58,2623the atoms involved in each of the contacts you wish to calculateSWITCH252={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5519157648086548}The switching functions to use for each of the contacts in your mapWEIGHT252=0.001272264631043257A weight value for a given contact, by default is 1ATOMS253=58,2625the atoms involved in each of the contacts you wish to calculateSWITCH253={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5165712833404541}The switching functions to use for each of the contacts in your mapWEIGHT253=0.001272264631043257A weight value for a given contact, by default is 1ATOMS254=58,2627the atoms involved in each of the contacts you wish to calculateSWITCH254={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3691733479499817}The switching functions to use for each of the contacts in your mapWEIGHT254=0.001272264631043257A weight value for a given contact, by default is 1ATOMS255=58,2631the atoms involved in each of the contacts you wish to calculateSWITCH255={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5959714651107788}The switching functions to use for each of the contacts in your mapWEIGHT255=0.001272264631043257A weight value for a given contact, by default is 1ATOMS256=62,2491the atoms involved in each of the contacts you wish to calculateSWITCH256={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5655525326728821}The switching functions to use for each of the contacts in your mapWEIGHT256=0.001272264631043257A weight value for a given contact, by default is 1ATOMS257=62,2493the atoms involved in each of the contacts you wish to calculateSWITCH257={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5495582818984985}The switching functions to use for each of the contacts in your mapWEIGHT257=0.001272264631043257A weight value for a given contact, by default is 1ATOMS258=62,2556the atoms involved in each of the contacts you wish to calculateSWITCH258={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4751369059085846}The switching functions to use for each of the contacts in your mapWEIGHT258=0.001272264631043257A weight value for a given contact, by default is 1ATOMS259=62,2558the atoms involved in each of the contacts you wish to calculateSWITCH259={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4657337963581085}The switching functions to use for each of the contacts in your mapWEIGHT259=0.001272264631043257A weight value for a given contact, by default is 1ATOMS260=62,2561the atoms involved in each of the contacts you wish to calculateSWITCH260={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4843510687351227}The switching functions to use for each of the contacts in your mapWEIGHT260=0.001272264631043257A weight value for a given contact, by default is 1ATOMS261=62,2562the atoms involved in each of the contacts you wish to calculateSWITCH261={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4442937672138214}The switching functions to use for each of the contacts in your mapWEIGHT261=0.001272264631043257A weight value for a given contact, by default is 1ATOMS262=62,2563the atoms involved in each of the contacts you wish to calculateSWITCH262={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5780813097953796}The switching functions to use for each of the contacts in your mapWEIGHT262=0.001272264631043257A weight value for a given contact, by default is 1ATOMS263=62,2564the atoms involved in each of the contacts you wish to calculateSWITCH263={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5005496740341187}The switching functions to use for each of the contacts in your mapWEIGHT263=0.001272264631043257A weight value for a given contact, by default is 1ATOMS264=62,2565the atoms involved in each of the contacts you wish to calculateSWITCH264={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44313547015190125}The switching functions to use for each of the contacts in your mapWEIGHT264=0.001272264631043257A weight value for a given contact, by default is 1ATOMS265=62,2608the atoms involved in each of the contacts you wish to calculateSWITCH265={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4947896897792816}The switching functions to use for each of the contacts in your mapWEIGHT265=0.001272264631043257A weight value for a given contact, by default is 1ATOMS266=62,2611the atoms involved in each of the contacts you wish to calculateSWITCH266={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5249516367912292}The switching functions to use for each of the contacts in your mapWEIGHT266=0.001272264631043257A weight value for a given contact, by default is 1ATOMS267=62,2614the atoms involved in each of the contacts you wish to calculateSWITCH267={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4355570673942566}The switching functions to use for each of the contacts in your mapWEIGHT267=0.001272264631043257A weight value for a given contact, by default is 1ATOMS268=62,2615the atoms involved in each of the contacts you wish to calculateSWITCH268={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.574617862701416}The switching functions to use for each of the contacts in your mapWEIGHT268=0.001272264631043257A weight value for a given contact, by default is 1ATOMS269=62,2627the atoms involved in each of the contacts you wish to calculateSWITCH269={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5743849873542786}The switching functions to use for each of the contacts in your mapWEIGHT269=0.001272264631043257A weight value for a given contact, by default is 1ATOMS270=65,2491the atoms involved in each of the contacts you wish to calculateSWITCH270={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49618029594421387}The switching functions to use for each of the contacts in your mapWEIGHT270=0.001272264631043257A weight value for a given contact, by default is 1ATOMS271=65,2493the atoms involved in each of the contacts you wish to calculateSWITCH271={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4935963451862335}The switching functions to use for each of the contacts in your mapWEIGHT271=0.001272264631043257A weight value for a given contact, by default is 1ATOMS272=65,2554the atoms involved in each of the contacts you wish to calculateSWITCH272={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5729231238365173}The switching functions to use for each of the contacts in your mapWEIGHT272=0.001272264631043257A weight value for a given contact, by default is 1ATOMS273=65,2556the atoms involved in each of the contacts you wish to calculateSWITCH273={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4475287199020386}The switching functions to use for each of the contacts in your mapWEIGHT273=0.001272264631043257A weight value for a given contact, by default is 1ATOMS274=65,2558the atoms involved in each of the contacts you wish to calculateSWITCH274={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.39825743436813354}The switching functions to use for each of the contacts in your mapWEIGHT274=0.001272264631043257A weight value for a given contact, by default is 1ATOMS275=65,2561the atoms involved in each of the contacts you wish to calculateSWITCH275={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3807951509952545}The switching functions to use for each of the contacts in your mapWEIGHT275=0.001272264631043257A weight value for a given contact, by default is 1ATOMS276=65,2562the atoms involved in each of the contacts you wish to calculateSWITCH276={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.346707284450531}The switching functions to use for each of the contacts in your mapWEIGHT276=0.001272264631043257A weight value for a given contact, by default is 1ATOMS277=65,2563the atoms involved in each of the contacts you wish to calculateSWITCH277={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.45603838562965393}The switching functions to use for each of the contacts in your mapWEIGHT277=0.001272264631043257A weight value for a given contact, by default is 1ATOMS278=65,2564the atoms involved in each of the contacts you wish to calculateSWITCH278={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5080836415290833}The switching functions to use for each of the contacts in your mapWEIGHT278=0.001272264631043257A weight value for a given contact, by default is 1ATOMS279=65,2565the atoms involved in each of the contacts you wish to calculateSWITCH279={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48635584115982056}The switching functions to use for each of the contacts in your mapWEIGHT279=0.001272264631043257A weight value for a given contact, by default is 1ATOMS280=65,2614the atoms involved in each of the contacts you wish to calculateSWITCH280={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.513218104839325}The switching functions to use for each of the contacts in your mapWEIGHT280=0.001272264631043257A weight value for a given contact, by default is 1ATOMS281=69,119the atoms involved in each of the contacts you wish to calculateSWITCH281={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4192432761192322}The switching functions to use for each of the contacts in your mapWEIGHT281=0.001272264631043257A weight value for a given contact, by default is 1ATOMS282=69,121the atoms involved in each of the contacts you wish to calculateSWITCH282={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5216367244720459}The switching functions to use for each of the contacts in your mapWEIGHT282=0.001272264631043257A weight value for a given contact, by default is 1ATOMS283=69,123the atoms involved in each of the contacts you wish to calculateSWITCH283={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5017626285552979}The switching functions to use for each of the contacts in your mapWEIGHT283=0.001272264631043257A weight value for a given contact, by default is 1ATOMS284=69,2489the atoms involved in each of the contacts you wish to calculateSWITCH284={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5235073566436768}The switching functions to use for each of the contacts in your mapWEIGHT284=0.001272264631043257A weight value for a given contact, by default is 1ATOMS285=69,2491the atoms involved in each of the contacts you wish to calculateSWITCH285={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5529934167861938}The switching functions to use for each of the contacts in your mapWEIGHT285=0.001272264631043257A weight value for a given contact, by default is 1ATOMS286=69,2493the atoms involved in each of the contacts you wish to calculateSWITCH286={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.45906662940979004}The switching functions to use for each of the contacts in your mapWEIGHT286=0.001272264631043257A weight value for a given contact, by default is 1ATOMS287=69,2627the atoms involved in each of the contacts you wish to calculateSWITCH287={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.46680837869644165}The switching functions to use for each of the contacts in your mapWEIGHT287=0.001272264631043257A weight value for a given contact, by default is 1ATOMS288=70,119the atoms involved in each of the contacts you wish to calculateSWITCH288={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.30375340580940247}The switching functions to use for each of the contacts in your mapWEIGHT288=0.001272264631043257A weight value for a given contact, by default is 1ATOMS289=70,121the atoms involved in each of the contacts you wish to calculateSWITCH289={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.402688592672348}The switching functions to use for each of the contacts in your mapWEIGHT289=0.001272264631043257A weight value for a given contact, by default is 1ATOMS290=70,123the atoms involved in each of the contacts you wish to calculateSWITCH290={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.39134252071380615}The switching functions to use for each of the contacts in your mapWEIGHT290=0.001272264631043257A weight value for a given contact, by default is 1ATOMS291=70,126the atoms involved in each of the contacts you wish to calculateSWITCH291={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5372466444969177}The switching functions to use for each of the contacts in your mapWEIGHT291=0.001272264631043257A weight value for a given contact, by default is 1ATOMS292=70,128the atoms involved in each of the contacts you wish to calculateSWITCH292={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5952891707420349}The switching functions to use for each of the contacts in your mapWEIGHT292=0.001272264631043257A weight value for a given contact, by default is 1ATOMS293=70,132the atoms involved in each of the contacts you wish to calculateSWITCH293={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5877977013587952}The switching functions to use for each of the contacts in your mapWEIGHT293=0.001272264631043257A weight value for a given contact, by default is 1ATOMS294=70,136the atoms involved in each of the contacts you wish to calculateSWITCH294={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5143227577209473}The switching functions to use for each of the contacts in your mapWEIGHT294=0.001272264631043257A weight value for a given contact, by default is 1ATOMS295=70,138the atoms involved in each of the contacts you wish to calculateSWITCH295={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5109609365463257}The switching functions to use for each of the contacts in your mapWEIGHT295=0.001272264631043257A weight value for a given contact, by default is 1ATOMS296=70,2487the atoms involved in each of the contacts you wish to calculateSWITCH296={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5545793771743774}The switching functions to use for each of the contacts in your mapWEIGHT296=0.001272264631043257A weight value for a given contact, by default is 1ATOMS297=70,2489the atoms involved in each of the contacts you wish to calculateSWITCH297={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4219445288181305}The switching functions to use for each of the contacts in your mapWEIGHT297=0.001272264631043257A weight value for a given contact, by default is 1ATOMS298=70,2491the atoms involved in each of the contacts you wish to calculateSWITCH298={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49128490686416626}The switching functions to use for each of the contacts in your mapWEIGHT298=0.001272264631043257A weight value for a given contact, by default is 1ATOMS299=70,2493the atoms involved in each of the contacts you wish to calculateSWITCH299={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3805406987667084}The switching functions to use for each of the contacts in your mapWEIGHT299=0.001272264631043257A weight value for a given contact, by default is 1ATOMS300=70,2627the atoms involved in each of the contacts you wish to calculateSWITCH300={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4766139090061188}The switching functions to use for each of the contacts in your mapWEIGHT300=0.001272264631043257A weight value for a given contact, by default is 1ATOMS301=71,2493the atoms involved in each of the contacts you wish to calculateSWITCH301={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5805965662002563}The switching functions to use for each of the contacts in your mapWEIGHT301=0.001272264631043257A weight value for a given contact, by default is 1ATOMS302=71,2623the atoms involved in each of the contacts you wish to calculateSWITCH302={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5917905569076538}The switching functions to use for each of the contacts in your mapWEIGHT302=0.001272264631043257A weight value for a given contact, by default is 1ATOMS303=71,2625the atoms involved in each of the contacts you wish to calculateSWITCH303={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5675287842750549}The switching functions to use for each of the contacts in your mapWEIGHT303=0.001272264631043257A weight value for a given contact, by default is 1ATOMS304=71,2627the atoms involved in each of the contacts you wish to calculateSWITCH304={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44709062576293945}The switching functions to use for each of the contacts in your mapWEIGHT304=0.001272264631043257A weight value for a given contact, by default is 1ATOMS305=71,2672the atoms involved in each of the contacts you wish to calculateSWITCH305={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5566729307174683}The switching functions to use for each of the contacts in your mapWEIGHT305=0.001272264631043257A weight value for a given contact, by default is 1ATOMS306=71,2675the atoms involved in each of the contacts you wish to calculateSWITCH306={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5266213417053223}The switching functions to use for each of the contacts in your mapWEIGHT306=0.001272264631043257A weight value for a given contact, by default is 1ATOMS307=73,138the atoms involved in each of the contacts you wish to calculateSWITCH307={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5262144207954407}The switching functions to use for each of the contacts in your mapWEIGHT307=0.001272264631043257A weight value for a given contact, by default is 1ATOMS308=73,142the atoms involved in each of the contacts you wish to calculateSWITCH308={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5642985105514526}The switching functions to use for each of the contacts in your mapWEIGHT308=0.001272264631043257A weight value for a given contact, by default is 1ATOMS309=73,145the atoms involved in each of the contacts you wish to calculateSWITCH309={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5166874527931213}The switching functions to use for each of the contacts in your mapWEIGHT309=0.001272264631043257A weight value for a given contact, by default is 1ATOMS310=73,2623the atoms involved in each of the contacts you wish to calculateSWITCH310={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5695807337760925}The switching functions to use for each of the contacts in your mapWEIGHT310=0.001272264631043257A weight value for a given contact, by default is 1ATOMS311=73,2625the atoms involved in each of the contacts you wish to calculateSWITCH311={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5300518870353699}The switching functions to use for each of the contacts in your mapWEIGHT311=0.001272264631043257A weight value for a given contact, by default is 1ATOMS312=73,2627the atoms involved in each of the contacts you wish to calculateSWITCH312={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4312378168106079}The switching functions to use for each of the contacts in your mapWEIGHT312=0.001272264631043257A weight value for a given contact, by default is 1ATOMS313=73,2672the atoms involved in each of the contacts you wish to calculateSWITCH313={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5113325119018555}The switching functions to use for each of the contacts in your mapWEIGHT313=0.001272264631043257A weight value for a given contact, by default is 1ATOMS314=73,2675the atoms involved in each of the contacts you wish to calculateSWITCH314={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5218219757080078}The switching functions to use for each of the contacts in your mapWEIGHT314=0.001272264631043257A weight value for a given contact, by default is 1ATOMS315=75,145the atoms involved in each of the contacts you wish to calculateSWITCH315={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5461666584014893}The switching functions to use for each of the contacts in your mapWEIGHT315=0.001272264631043257A weight value for a given contact, by default is 1ATOMS316=75,2623the atoms involved in each of the contacts you wish to calculateSWITCH316={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5463424921035767}The switching functions to use for each of the contacts in your mapWEIGHT316=0.001272264631043257A weight value for a given contact, by default is 1ATOMS317=75,2625the atoms involved in each of the contacts you wish to calculateSWITCH317={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5381700396537781}The switching functions to use for each of the contacts in your mapWEIGHT317=0.001272264631043257A weight value for a given contact, by default is 1ATOMS318=75,2627the atoms involved in each of the contacts you wish to calculateSWITCH318={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4755480885505676}The switching functions to use for each of the contacts in your mapWEIGHT318=0.001272264631043257A weight value for a given contact, by default is 1ATOMS319=75,2636the atoms involved in each of the contacts you wish to calculateSWITCH319={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5511779189109802}The switching functions to use for each of the contacts in your mapWEIGHT319=0.001272264631043257A weight value for a given contact, by default is 1ATOMS320=75,2670the atoms involved in each of the contacts you wish to calculateSWITCH320={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5225564241409302}The switching functions to use for each of the contacts in your mapWEIGHT320=0.001272264631043257A weight value for a given contact, by default is 1ATOMS321=75,2672the atoms involved in each of the contacts you wish to calculateSWITCH321={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.37662312388420105}The switching functions to use for each of the contacts in your mapWEIGHT321=0.001272264631043257A weight value for a given contact, by default is 1ATOMS322=75,2675the atoms involved in each of the contacts you wish to calculateSWITCH322={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4034428596496582}The switching functions to use for each of the contacts in your mapWEIGHT322=0.001272264631043257A weight value for a given contact, by default is 1ATOMS323=75,2678the atoms involved in each of the contacts you wish to calculateSWITCH323={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48040005564689636}The switching functions to use for each of the contacts in your mapWEIGHT323=0.001272264631043257A weight value for a given contact, by default is 1ATOMS324=75,2679the atoms involved in each of the contacts you wish to calculateSWITCH324={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5620198249816895}The switching functions to use for each of the contacts in your mapWEIGHT324=0.001272264631043257A weight value for a given contact, by default is 1ATOMS325=75,2680the atoms involved in each of the contacts you wish to calculateSWITCH325={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49693572521209717}The switching functions to use for each of the contacts in your mapWEIGHT325=0.001272264631043257A weight value for a given contact, by default is 1ATOMS326=75,2683the atoms involved in each of the contacts you wish to calculateSWITCH326={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.550622284412384}The switching functions to use for each of the contacts in your mapWEIGHT326=0.001272264631043257A weight value for a given contact, by default is 1ATOMS327=75,2684the atoms involved in each of the contacts you wish to calculateSWITCH327={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5932227373123169}The switching functions to use for each of the contacts in your mapWEIGHT327=0.001272264631043257A weight value for a given contact, by default is 1ATOMS328=75,2685the atoms involved in each of the contacts you wish to calculateSWITCH328={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5753479599952698}The switching functions to use for each of the contacts in your mapWEIGHT328=0.001272264631043257A weight value for a given contact, by default is 1ATOMS329=75,2757the atoms involved in each of the contacts you wish to calculateSWITCH329={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5216971635818481}The switching functions to use for each of the contacts in your mapWEIGHT329=0.001272264631043257A weight value for a given contact, by default is 1ATOMS330=75,2760the atoms involved in each of the contacts you wish to calculateSWITCH330={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.579897403717041}The switching functions to use for each of the contacts in your mapWEIGHT330=0.001272264631043257A weight value for a given contact, by default is 1ATOMS331=78,138the atoms involved in each of the contacts you wish to calculateSWITCH331={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5930233597755432}The switching functions to use for each of the contacts in your mapWEIGHT331=0.001272264631043257A weight value for a given contact, by default is 1ATOMS332=78,142the atoms involved in each of the contacts you wish to calculateSWITCH332={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.52531898021698}The switching functions to use for each of the contacts in your mapWEIGHT332=0.001272264631043257A weight value for a given contact, by default is 1ATOMS333=78,145the atoms involved in each of the contacts you wish to calculateSWITCH333={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44403955340385437}The switching functions to use for each of the contacts in your mapWEIGHT333=0.001272264631043257A weight value for a given contact, by default is 1ATOMS334=78,148the atoms involved in each of the contacts you wish to calculateSWITCH334={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5833463668823242}The switching functions to use for each of the contacts in your mapWEIGHT334=0.001272264631043257A weight value for a given contact, by default is 1ATOMS335=78,149the atoms involved in each of the contacts you wish to calculateSWITCH335={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5318777561187744}The switching functions to use for each of the contacts in your mapWEIGHT335=0.001272264631043257A weight value for a given contact, by default is 1ATOMS336=78,2623the atoms involved in each of the contacts you wish to calculateSWITCH336={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5706601738929749}The switching functions to use for each of the contacts in your mapWEIGHT336=0.001272264631043257A weight value for a given contact, by default is 1ATOMS337=78,2625the atoms involved in each of the contacts you wish to calculateSWITCH337={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5489060878753662}The switching functions to use for each of the contacts in your mapWEIGHT337=0.001272264631043257A weight value for a given contact, by default is 1ATOMS338=78,2627the atoms involved in each of the contacts you wish to calculateSWITCH338={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5168857574462891}The switching functions to use for each of the contacts in your mapWEIGHT338=0.001272264631043257A weight value for a given contact, by default is 1ATOMS339=78,2636the atoms involved in each of the contacts you wish to calculateSWITCH339={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.526077926158905}The switching functions to use for each of the contacts in your mapWEIGHT339=0.001272264631043257A weight value for a given contact, by default is 1ATOMS340=78,2670the atoms involved in each of the contacts you wish to calculateSWITCH340={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5074860453605652}The switching functions to use for each of the contacts in your mapWEIGHT340=0.001272264631043257A weight value for a given contact, by default is 1ATOMS341=78,2672the atoms involved in each of the contacts you wish to calculateSWITCH341={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3855539858341217}The switching functions to use for each of the contacts in your mapWEIGHT341=0.001272264631043257A weight value for a given contact, by default is 1ATOMS342=78,2675the atoms involved in each of the contacts you wish to calculateSWITCH342={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4632936120033264}The switching functions to use for each of the contacts in your mapWEIGHT342=0.001272264631043257A weight value for a given contact, by default is 1ATOMS343=78,2678the atoms involved in each of the contacts you wish to calculateSWITCH343={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5396860837936401}The switching functions to use for each of the contacts in your mapWEIGHT343=0.001272264631043257A weight value for a given contact, by default is 1ATOMS344=78,2680the atoms involved in each of the contacts you wish to calculateSWITCH344={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5255682468414307}The switching functions to use for each of the contacts in your mapWEIGHT344=0.001272264631043257A weight value for a given contact, by default is 1ATOMS345=78,2683the atoms involved in each of the contacts you wish to calculateSWITCH345={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4937547743320465}The switching functions to use for each of the contacts in your mapWEIGHT345=0.001272264631043257A weight value for a given contact, by default is 1ATOMS346=78,2684the atoms involved in each of the contacts you wish to calculateSWITCH346={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5237385630607605}The switching functions to use for each of the contacts in your mapWEIGHT346=0.001272264631043257A weight value for a given contact, by default is 1ATOMS347=78,2685the atoms involved in each of the contacts you wish to calculateSWITCH347={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5033548474311829}The switching functions to use for each of the contacts in your mapWEIGHT347=0.001272264631043257A weight value for a given contact, by default is 1ATOMS348=78,2687the atoms involved in each of the contacts you wish to calculateSWITCH348={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5341854691505432}The switching functions to use for each of the contacts in your mapWEIGHT348=0.001272264631043257A weight value for a given contact, by default is 1ATOMS349=78,2689the atoms involved in each of the contacts you wish to calculateSWITCH349={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5978879332542419}The switching functions to use for each of the contacts in your mapWEIGHT349=0.001272264631043257A weight value for a given contact, by default is 1ATOMS350=78,2751the atoms involved in each of the contacts you wish to calculateSWITCH350={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4983763098716736}The switching functions to use for each of the contacts in your mapWEIGHT350=0.001272264631043257A weight value for a given contact, by default is 1ATOMS351=78,2754the atoms involved in each of the contacts you wish to calculateSWITCH351={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.532656729221344}The switching functions to use for each of the contacts in your mapWEIGHT351=0.001272264631043257A weight value for a given contact, by default is 1ATOMS352=78,2757the atoms involved in each of the contacts you wish to calculateSWITCH352={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.46444469690322876}The switching functions to use for each of the contacts in your mapWEIGHT352=0.001272264631043257A weight value for a given contact, by default is 1ATOMS353=78,2760the atoms involved in each of the contacts you wish to calculateSWITCH353={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5410969853401184}The switching functions to use for each of the contacts in your mapWEIGHT353=0.001272264631043257A weight value for a given contact, by default is 1ATOMS354=79,142the atoms involved in each of the contacts you wish to calculateSWITCH354={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.551453709602356}The switching functions to use for each of the contacts in your mapWEIGHT354=0.001272264631043257A weight value for a given contact, by default is 1ATOMS355=79,145the atoms involved in each of the contacts you wish to calculateSWITCH355={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4374862611293793}The switching functions to use for each of the contacts in your mapWEIGHT355=0.001272264631043257A weight value for a given contact, by default is 1ATOMS356=79,148the atoms involved in each of the contacts you wish to calculateSWITCH356={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.539935290813446}The switching functions to use for each of the contacts in your mapWEIGHT356=0.001272264631043257A weight value for a given contact, by default is 1ATOMS357=79,149the atoms involved in each of the contacts you wish to calculateSWITCH357={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4533641040325165}The switching functions to use for each of the contacts in your mapWEIGHT357=0.001272264631043257A weight value for a given contact, by default is 1ATOMS358=79,656the atoms involved in each of the contacts you wish to calculateSWITCH358={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5627663731575012}The switching functions to use for each of the contacts in your mapWEIGHT358=0.001272264631043257A weight value for a given contact, by default is 1ATOMS359=79,658the atoms involved in each of the contacts you wish to calculateSWITCH359={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5932503342628479}The switching functions to use for each of the contacts in your mapWEIGHT359=0.001272264631043257A weight value for a given contact, by default is 1ATOMS360=79,2623the atoms involved in each of the contacts you wish to calculateSWITCH360={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4883851408958435}The switching functions to use for each of the contacts in your mapWEIGHT360=0.001272264631043257A weight value for a given contact, by default is 1ATOMS361=79,2625the atoms involved in each of the contacts you wish to calculateSWITCH361={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4583721160888672}The switching functions to use for each of the contacts in your mapWEIGHT361=0.001272264631043257A weight value for a given contact, by default is 1ATOMS362=79,2627the atoms involved in each of the contacts you wish to calculateSWITCH362={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.45889216661453247}The switching functions to use for each of the contacts in your mapWEIGHT362=0.001272264631043257A weight value for a given contact, by default is 1ATOMS363=79,2631the atoms involved in each of the contacts you wish to calculateSWITCH363={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5897974371910095}The switching functions to use for each of the contacts in your mapWEIGHT363=0.001272264631043257A weight value for a given contact, by default is 1ATOMS364=79,2635the atoms involved in each of the contacts you wish to calculateSWITCH364={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5004206299781799}The switching functions to use for each of the contacts in your mapWEIGHT364=0.001272264631043257A weight value for a given contact, by default is 1ATOMS365=79,2636the atoms involved in each of the contacts you wish to calculateSWITCH365={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4208027422428131}The switching functions to use for each of the contacts in your mapWEIGHT365=0.001272264631043257A weight value for a given contact, by default is 1ATOMS366=79,2668the atoms involved in each of the contacts you wish to calculateSWITCH366={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.547883927822113}The switching functions to use for each of the contacts in your mapWEIGHT366=0.001272264631043257A weight value for a given contact, by default is 1ATOMS367=79,2670the atoms involved in each of the contacts you wish to calculateSWITCH367={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.47073233127593994}The switching functions to use for each of the contacts in your mapWEIGHT367=0.001272264631043257A weight value for a given contact, by default is 1ATOMS368=79,2672the atoms involved in each of the contacts you wish to calculateSWITCH368={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.37130147218704224}The switching functions to use for each of the contacts in your mapWEIGHT368=0.001272264631043257A weight value for a given contact, by default is 1ATOMS369=79,2675the atoms involved in each of the contacts you wish to calculateSWITCH369={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4750472903251648}The switching functions to use for each of the contacts in your mapWEIGHT369=0.001272264631043257A weight value for a given contact, by default is 1ATOMS370=79,2678the atoms involved in each of the contacts you wish to calculateSWITCH370={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5751712322235107}The switching functions to use for each of the contacts in your mapWEIGHT370=0.001272264631043257A weight value for a given contact, by default is 1ATOMS371=79,2680the atoms involved in each of the contacts you wish to calculateSWITCH371={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5653483867645264}The switching functions to use for each of the contacts in your mapWEIGHT371=0.001272264631043257A weight value for a given contact, by default is 1ATOMS372=79,2683the atoms involved in each of the contacts you wish to calculateSWITCH372={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.43768784403800964}The switching functions to use for each of the contacts in your mapWEIGHT372=0.001272264631043257A weight value for a given contact, by default is 1ATOMS373=79,2684the atoms involved in each of the contacts you wish to calculateSWITCH373={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4854326844215393}The switching functions to use for each of the contacts in your mapWEIGHT373=0.001272264631043257A weight value for a given contact, by default is 1ATOMS374=79,2685the atoms involved in each of the contacts you wish to calculateSWITCH374={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.41331222653388977}The switching functions to use for each of the contacts in your mapWEIGHT374=0.001272264631043257A weight value for a given contact, by default is 1ATOMS375=79,2687the atoms involved in each of the contacts you wish to calculateSWITCH375={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4333093464374542}The switching functions to use for each of the contacts in your mapWEIGHT375=0.001272264631043257A weight value for a given contact, by default is 1ATOMS376=79,2689the atoms involved in each of the contacts you wish to calculateSWITCH376={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4748903810977936}The switching functions to use for each of the contacts in your mapWEIGHT376=0.001272264631043257A weight value for a given contact, by default is 1ATOMS377=79,2692the atoms involved in each of the contacts you wish to calculateSWITCH377={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.498318076133728}The switching functions to use for each of the contacts in your mapWEIGHT377=0.001272264631043257A weight value for a given contact, by default is 1ATOMS378=79,2695the atoms involved in each of the contacts you wish to calculateSWITCH378={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5692757964134216}The switching functions to use for each of the contacts in your mapWEIGHT378=0.001272264631043257A weight value for a given contact, by default is 1ATOMS379=79,2698the atoms involved in each of the contacts you wish to calculateSWITCH379={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5925655364990234}The switching functions to use for each of the contacts in your mapWEIGHT379=0.001272264631043257A weight value for a given contact, by default is 1ATOMS380=79,2707the atoms involved in each of the contacts you wish to calculateSWITCH380={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5709666609764099}The switching functions to use for each of the contacts in your mapWEIGHT380=0.001272264631043257A weight value for a given contact, by default is 1ATOMS381=79,2751the atoms involved in each of the contacts you wish to calculateSWITCH381={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49925321340560913}The switching functions to use for each of the contacts in your mapWEIGHT381=0.001272264631043257A weight value for a given contact, by default is 1ATOMS382=79,2754the atoms involved in each of the contacts you wish to calculateSWITCH382={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5691062808036804}The switching functions to use for each of the contacts in your mapWEIGHT382=0.001272264631043257A weight value for a given contact, by default is 1ATOMS383=79,2757the atoms involved in each of the contacts you wish to calculateSWITCH383={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5216145515441895}The switching functions to use for each of the contacts in your mapWEIGHT383=0.001272264631043257A weight value for a given contact, by default is 1ATOMS384=79,2760the atoms involved in each of the contacts you wish to calculateSWITCH384={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5820074677467346}The switching functions to use for each of the contacts in your mapWEIGHT384=0.001272264631043257A weight value for a given contact, by default is 1ATOMS385=81,142the atoms involved in each of the contacts you wish to calculateSWITCH385={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.525982141494751}The switching functions to use for each of the contacts in your mapWEIGHT385=0.001272264631043257A weight value for a given contact, by default is 1ATOMS386=81,145the atoms involved in each of the contacts you wish to calculateSWITCH386={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3972786068916321}The switching functions to use for each of the contacts in your mapWEIGHT386=0.001272264631043257A weight value for a given contact, by default is 1ATOMS387=81,148the atoms involved in each of the contacts you wish to calculateSWITCH387={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.47352102398872375}The switching functions to use for each of the contacts in your mapWEIGHT387=0.001272264631043257A weight value for a given contact, by default is 1ATOMS388=81,149the atoms involved in each of the contacts you wish to calculateSWITCH388={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.39274802803993225}The switching functions to use for each of the contacts in your mapWEIGHT388=0.001272264631043257A weight value for a given contact, by default is 1ATOMS389=81,590the atoms involved in each of the contacts you wish to calculateSWITCH389={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5030259490013123}The switching functions to use for each of the contacts in your mapWEIGHT389=0.001272264631043257A weight value for a given contact, by default is 1ATOMS390=81,652the atoms involved in each of the contacts you wish to calculateSWITCH390={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5840497612953186}The switching functions to use for each of the contacts in your mapWEIGHT390=0.001272264631043257A weight value for a given contact, by default is 1ATOMS391=81,655the atoms involved in each of the contacts you wish to calculateSWITCH391={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5749348402023315}The switching functions to use for each of the contacts in your mapWEIGHT391=0.001272264631043257A weight value for a given contact, by default is 1ATOMS392=81,656the atoms involved in each of the contacts you wish to calculateSWITCH392={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49666285514831543}The switching functions to use for each of the contacts in your mapWEIGHT392=0.001272264631043257A weight value for a given contact, by default is 1ATOMS393=81,658the atoms involved in each of the contacts you wish to calculateSWITCH393={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5448539853096008}The switching functions to use for each of the contacts in your mapWEIGHT393=0.001272264631043257A weight value for a given contact, by default is 1ATOMS394=81,2623the atoms involved in each of the contacts you wish to calculateSWITCH394={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5673164129257202}The switching functions to use for each of the contacts in your mapWEIGHT394=0.001272264631043257A weight value for a given contact, by default is 1ATOMS395=81,2625the atoms involved in each of the contacts you wish to calculateSWITCH395={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5287578701972961}The switching functions to use for each of the contacts in your mapWEIGHT395=0.001272264631043257A weight value for a given contact, by default is 1ATOMS396=81,2627the atoms involved in each of the contacts you wish to calculateSWITCH396={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5546619296073914}The switching functions to use for each of the contacts in your mapWEIGHT396=0.001272264631043257A weight value for a given contact, by default is 1ATOMS397=81,2635the atoms involved in each of the contacts you wish to calculateSWITCH397={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5497933030128479}The switching functions to use for each of the contacts in your mapWEIGHT397=0.001272264631043257A weight value for a given contact, by default is 1ATOMS398=81,2636the atoms involved in each of the contacts you wish to calculateSWITCH398={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4579463303089142}The switching functions to use for each of the contacts in your mapWEIGHT398=0.001272264631043257A weight value for a given contact, by default is 1ATOMS399=81,2668the atoms involved in each of the contacts you wish to calculateSWITCH399={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.593340277671814}The switching functions to use for each of the contacts in your mapWEIGHT399=0.001272264631043257A weight value for a given contact, by default is 1ATOMS400=81,2670the atoms involved in each of the contacts you wish to calculateSWITCH400={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5140514373779297}The switching functions to use for each of the contacts in your mapWEIGHT400=0.001272264631043257A weight value for a given contact, by default is 1ATOMS401=81,2672the atoms involved in each of the contacts you wish to calculateSWITCH401={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4491288661956787}The switching functions to use for each of the contacts in your mapWEIGHT401=0.001272264631043257A weight value for a given contact, by default is 1ATOMS402=81,2675the atoms involved in each of the contacts you wish to calculateSWITCH402={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.575529158115387}The switching functions to use for each of the contacts in your mapWEIGHT402=0.001272264631043257A weight value for a given contact, by default is 1ATOMS403=81,2683the atoms involved in each of the contacts you wish to calculateSWITCH403={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4400666356086731}The switching functions to use for each of the contacts in your mapWEIGHT403=0.001272264631043257A weight value for a given contact, by default is 1ATOMS404=81,2684the atoms involved in each of the contacts you wish to calculateSWITCH404={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4698435068130493}The switching functions to use for each of the contacts in your mapWEIGHT404=0.001272264631043257A weight value for a given contact, by default is 1ATOMS405=81,2685the atoms involved in each of the contacts you wish to calculateSWITCH405={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.39517462253570557}The switching functions to use for each of the contacts in your mapWEIGHT405=0.001272264631043257A weight value for a given contact, by default is 1ATOMS406=81,2687the atoms involved in each of the contacts you wish to calculateSWITCH406={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3681969940662384}The switching functions to use for each of the contacts in your mapWEIGHT406=0.001272264631043257A weight value for a given contact, by default is 1ATOMS407=81,2689the atoms involved in each of the contacts you wish to calculateSWITCH407={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.40097489953041077}The switching functions to use for each of the contacts in your mapWEIGHT407=0.001272264631043257A weight value for a given contact, by default is 1ATOMS408=81,2692the atoms involved in each of the contacts you wish to calculateSWITCH408={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.39221546053886414}The switching functions to use for each of the contacts in your mapWEIGHT408=0.001272264631043257A weight value for a given contact, by default is 1ATOMS409=81,2695the atoms involved in each of the contacts you wish to calculateSWITCH409={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44683220982551575}The switching functions to use for each of the contacts in your mapWEIGHT409=0.001272264631043257A weight value for a given contact, by default is 1ATOMS410=81,2698the atoms involved in each of the contacts you wish to calculateSWITCH410={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.45773574709892273}The switching functions to use for each of the contacts in your mapWEIGHT410=0.001272264631043257A weight value for a given contact, by default is 1ATOMS411=81,2700the atoms involved in each of the contacts you wish to calculateSWITCH411={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5613145232200623}The switching functions to use for each of the contacts in your mapWEIGHT411=0.001272264631043257A weight value for a given contact, by default is 1ATOMS412=81,2707the atoms involved in each of the contacts you wish to calculateSWITCH412={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49785441160202026}The switching functions to use for each of the contacts in your mapWEIGHT412=0.001272264631043257A weight value for a given contact, by default is 1ATOMS413=81,2708the atoms involved in each of the contacts you wish to calculateSWITCH413={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5256737470626831}The switching functions to use for each of the contacts in your mapWEIGHT413=0.001272264631043257A weight value for a given contact, by default is 1ATOMS414=81,2748the atoms involved in each of the contacts you wish to calculateSWITCH414={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5309133529663086}The switching functions to use for each of the contacts in your mapWEIGHT414=0.001272264631043257A weight value for a given contact, by default is 1ATOMS415=81,2751the atoms involved in each of the contacts you wish to calculateSWITCH415={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4373578131198883}The switching functions to use for each of the contacts in your mapWEIGHT415=0.001272264631043257A weight value for a given contact, by default is 1ATOMS416=81,2754the atoms involved in each of the contacts you wish to calculateSWITCH416={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5361772775650024}The switching functions to use for each of the contacts in your mapWEIGHT416=0.001272264631043257A weight value for a given contact, by default is 1ATOMS417=81,2757the atoms involved in each of the contacts you wish to calculateSWITCH417={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5267425775527954}The switching functions to use for each of the contacts in your mapWEIGHT417=0.001272264631043257A weight value for a given contact, by default is 1ATOMS418=81,2760the atoms involved in each of the contacts you wish to calculateSWITCH418={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5963361263275146}The switching functions to use for each of the contacts in your mapWEIGHT418=0.001272264631043257A weight value for a given contact, by default is 1ATOMS419=83,142the atoms involved in each of the contacts you wish to calculateSWITCH419={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4696520268917084}The switching functions to use for each of the contacts in your mapWEIGHT419=0.001272264631043257A weight value for a given contact, by default is 1ATOMS420=83,145the atoms involved in each of the contacts you wish to calculateSWITCH420={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3602140247821808}The switching functions to use for each of the contacts in your mapWEIGHT420=0.001272264631043257A weight value for a given contact, by default is 1ATOMS421=83,148the atoms involved in each of the contacts you wish to calculateSWITCH421={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.45357465744018555}The switching functions to use for each of the contacts in your mapWEIGHT421=0.001272264631043257A weight value for a given contact, by default is 1ATOMS422=83,149the atoms involved in each of the contacts you wish to calculateSWITCH422={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4248892366886139}The switching functions to use for each of the contacts in your mapWEIGHT422=0.001272264631043257A weight value for a given contact, by default is 1ATOMS423=83,586the atoms involved in each of the contacts you wish to calculateSWITCH423={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5716477036476135}The switching functions to use for each of the contacts in your mapWEIGHT423=0.001272264631043257A weight value for a given contact, by default is 1ATOMS424=83,590the atoms involved in each of the contacts you wish to calculateSWITCH424={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.42518115043640137}The switching functions to use for each of the contacts in your mapWEIGHT424=0.001272264631043257A weight value for a given contact, by default is 1ATOMS425=83,656the atoms involved in each of the contacts you wish to calculateSWITCH425={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5878111720085144}The switching functions to use for each of the contacts in your mapWEIGHT425=0.001272264631043257A weight value for a given contact, by default is 1ATOMS426=83,2636the atoms involved in each of the contacts you wish to calculateSWITCH426={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5849469304084778}The switching functions to use for each of the contacts in your mapWEIGHT426=0.001272264631043257A weight value for a given contact, by default is 1ATOMS427=83,2670the atoms involved in each of the contacts you wish to calculateSWITCH427={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5852016806602478}The switching functions to use for each of the contacts in your mapWEIGHT427=0.001272264631043257A weight value for a given contact, by default is 1ATOMS428=83,2672the atoms involved in each of the contacts you wish to calculateSWITCH428={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5251750349998474}The switching functions to use for each of the contacts in your mapWEIGHT428=0.001272264631043257A weight value for a given contact, by default is 1ATOMS429=83,2683the atoms involved in each of the contacts you wish to calculateSWITCH429={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4977095127105713}The switching functions to use for each of the contacts in your mapWEIGHT429=0.001272264631043257A weight value for a given contact, by default is 1ATOMS430=83,2684the atoms involved in each of the contacts you wish to calculateSWITCH430={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49413058161735535}The switching functions to use for each of the contacts in your mapWEIGHT430=0.001272264631043257A weight value for a given contact, by default is 1ATOMS431=83,2685the atoms involved in each of the contacts you wish to calculateSWITCH431={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4733150005340576}The switching functions to use for each of the contacts in your mapWEIGHT431=0.001272264631043257A weight value for a given contact, by default is 1ATOMS432=83,2687the atoms involved in each of the contacts you wish to calculateSWITCH432={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.42556920647621155}The switching functions to use for each of the contacts in your mapWEIGHT432=0.001272264631043257A weight value for a given contact, by default is 1ATOMS433=83,2689the atoms involved in each of the contacts you wish to calculateSWITCH433={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.477904736995697}The switching functions to use for each of the contacts in your mapWEIGHT433=0.001272264631043257A weight value for a given contact, by default is 1ATOMS434=83,2692the atoms involved in each of the contacts you wish to calculateSWITCH434={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44439736008644104}The switching functions to use for each of the contacts in your mapWEIGHT434=0.001272264631043257A weight value for a given contact, by default is 1ATOMS435=83,2695the atoms involved in each of the contacts you wish to calculateSWITCH435={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4543248414993286}The switching functions to use for each of the contacts in your mapWEIGHT435=0.001272264631043257A weight value for a given contact, by default is 1ATOMS436=83,2698the atoms involved in each of the contacts you wish to calculateSWITCH436={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4393700361251831}The switching functions to use for each of the contacts in your mapWEIGHT436=0.001272264631043257A weight value for a given contact, by default is 1ATOMS437=83,2700the atoms involved in each of the contacts you wish to calculateSWITCH437={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.515354335308075}The switching functions to use for each of the contacts in your mapWEIGHT437=0.001272264631043257A weight value for a given contact, by default is 1ATOMS438=83,2704the atoms involved in each of the contacts you wish to calculateSWITCH438={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5452898740768433}The switching functions to use for each of the contacts in your mapWEIGHT438=0.001272264631043257A weight value for a given contact, by default is 1ATOMS439=83,2707the atoms involved in each of the contacts you wish to calculateSWITCH439={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5284422039985657}The switching functions to use for each of the contacts in your mapWEIGHT439=0.001272264631043257A weight value for a given contact, by default is 1ATOMS440=83,2708the atoms involved in each of the contacts you wish to calculateSWITCH440={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5247409343719482}The switching functions to use for each of the contacts in your mapWEIGHT440=0.001272264631043257A weight value for a given contact, by default is 1ATOMS441=83,2746the atoms involved in each of the contacts you wish to calculateSWITCH441={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5923064351081848}The switching functions to use for each of the contacts in your mapWEIGHT441=0.001272264631043257A weight value for a given contact, by default is 1ATOMS442=83,2748the atoms involved in each of the contacts you wish to calculateSWITCH442={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4496588110923767}The switching functions to use for each of the contacts in your mapWEIGHT442=0.001272264631043257A weight value for a given contact, by default is 1ATOMS443=83,2751the atoms involved in each of the contacts you wish to calculateSWITCH443={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.36316099762916565}The switching functions to use for each of the contacts in your mapWEIGHT443=0.001272264631043257A weight value for a given contact, by default is 1ATOMS444=83,2754the atoms involved in each of the contacts you wish to calculateSWITCH444={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4583472013473511}The switching functions to use for each of the contacts in your mapWEIGHT444=0.001272264631043257A weight value for a given contact, by default is 1ATOMS445=83,2757the atoms involved in each of the contacts you wish to calculateSWITCH445={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.47484084963798523}The switching functions to use for each of the contacts in your mapWEIGHT445=0.001272264631043257A weight value for a given contact, by default is 1ATOMS446=83,2760the atoms involved in each of the contacts you wish to calculateSWITCH446={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5706040263175964}The switching functions to use for each of the contacts in your mapWEIGHT446=0.001272264631043257A weight value for a given contact, by default is 1ATOMS447=84,142the atoms involved in each of the contacts you wish to calculateSWITCH447={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5002650022506714}The switching functions to use for each of the contacts in your mapWEIGHT447=0.001272264631043257A weight value for a given contact, by default is 1ATOMS448=84,145the atoms involved in each of the contacts you wish to calculateSWITCH448={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3920181095600128}The switching functions to use for each of the contacts in your mapWEIGHT448=0.001272264631043257A weight value for a given contact, by default is 1ATOMS449=84,148the atoms involved in each of the contacts you wish to calculateSWITCH449={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44182348251342773}The switching functions to use for each of the contacts in your mapWEIGHT449=0.001272264631043257A weight value for a given contact, by default is 1ATOMS450=84,149the atoms involved in each of the contacts you wish to calculateSWITCH450={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4325238764286041}The switching functions to use for each of the contacts in your mapWEIGHT450=0.001272264631043257A weight value for a given contact, by default is 1ATOMS451=84,584the atoms involved in each of the contacts you wish to calculateSWITCH451={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5641710758209229}The switching functions to use for each of the contacts in your mapWEIGHT451=0.001272264631043257A weight value for a given contact, by default is 1ATOMS452=84,586the atoms involved in each of the contacts you wish to calculateSWITCH452={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4594290852546692}The switching functions to use for each of the contacts in your mapWEIGHT452=0.001272264631043257A weight value for a given contact, by default is 1ATOMS453=84,588the atoms involved in each of the contacts you wish to calculateSWITCH453={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5039883255958557}The switching functions to use for each of the contacts in your mapWEIGHT453=0.001272264631043257A weight value for a given contact, by default is 1ATOMS454=84,590the atoms involved in each of the contacts you wish to calculateSWITCH454={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3194636404514313}The switching functions to use for each of the contacts in your mapWEIGHT454=0.001272264631043257A weight value for a given contact, by default is 1ATOMS455=84,594the atoms involved in each of the contacts you wish to calculateSWITCH455={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5733846426010132}The switching functions to use for each of the contacts in your mapWEIGHT455=0.001272264631043257A weight value for a given contact, by default is 1ATOMS456=84,595the atoms involved in each of the contacts you wish to calculateSWITCH456={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5550082921981812}The switching functions to use for each of the contacts in your mapWEIGHT456=0.001272264631043257A weight value for a given contact, by default is 1ATOMS457=84,652the atoms involved in each of the contacts you wish to calculateSWITCH457={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5713930726051331}The switching functions to use for each of the contacts in your mapWEIGHT457=0.001272264631043257A weight value for a given contact, by default is 1ATOMS458=84,656the atoms involved in each of the contacts you wish to calculateSWITCH458={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5781124234199524}The switching functions to use for each of the contacts in your mapWEIGHT458=0.001272264631043257A weight value for a given contact, by default is 1ATOMS459=84,2683the atoms involved in each of the contacts you wish to calculateSWITCH459={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5569853782653809}The switching functions to use for each of the contacts in your mapWEIGHT459=0.001272264631043257A weight value for a given contact, by default is 1ATOMS460=84,2684the atoms involved in each of the contacts you wish to calculateSWITCH460={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.537582516670227}The switching functions to use for each of the contacts in your mapWEIGHT460=0.001272264631043257A weight value for a given contact, by default is 1ATOMS461=84,2685the atoms involved in each of the contacts you wish to calculateSWITCH461={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5191464424133301}The switching functions to use for each of the contacts in your mapWEIGHT461=0.001272264631043257A weight value for a given contact, by default is 1ATOMS462=84,2687the atoms involved in each of the contacts you wish to calculateSWITCH462={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4334825575351715}The switching functions to use for each of the contacts in your mapWEIGHT462=0.001272264631043257A weight value for a given contact, by default is 1ATOMS463=84,2689the atoms involved in each of the contacts you wish to calculateSWITCH463={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4717487394809723}The switching functions to use for each of the contacts in your mapWEIGHT463=0.001272264631043257A weight value for a given contact, by default is 1ATOMS464=84,2692the atoms involved in each of the contacts you wish to calculateSWITCH464={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4009949862957001}The switching functions to use for each of the contacts in your mapWEIGHT464=0.001272264631043257A weight value for a given contact, by default is 1ATOMS465=84,2695the atoms involved in each of the contacts you wish to calculateSWITCH465={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3724633753299713}The switching functions to use for each of the contacts in your mapWEIGHT465=0.001272264631043257A weight value for a given contact, by default is 1ATOMS466=84,2698the atoms involved in each of the contacts you wish to calculateSWITCH466={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.327600359916687}The switching functions to use for each of the contacts in your mapWEIGHT466=0.001272264631043257A weight value for a given contact, by default is 1ATOMS467=84,2700the atoms involved in each of the contacts you wish to calculateSWITCH467={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3835701048374176}The switching functions to use for each of the contacts in your mapWEIGHT467=0.001272264631043257A weight value for a given contact, by default is 1ATOMS468=84,2701the atoms involved in each of the contacts you wish to calculateSWITCH468={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4734238088130951}The switching functions to use for each of the contacts in your mapWEIGHT468=0.001272264631043257A weight value for a given contact, by default is 1ATOMS469=84,2704the atoms involved in each of the contacts you wish to calculateSWITCH469={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.40682312846183777}The switching functions to use for each of the contacts in your mapWEIGHT469=0.001272264631043257A weight value for a given contact, by default is 1ATOMS470=84,2707the atoms involved in each of the contacts you wish to calculateSWITCH470={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5094203352928162}The switching functions to use for each of the contacts in your mapWEIGHT470=0.001272264631043257A weight value for a given contact, by default is 1ATOMS471=84,2708the atoms involved in each of the contacts you wish to calculateSWITCH471={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4797842502593994}The switching functions to use for each of the contacts in your mapWEIGHT471=0.001272264631043257A weight value for a given contact, by default is 1ATOMS472=84,2744the atoms involved in each of the contacts you wish to calculateSWITCH472={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5994447469711304}The switching functions to use for each of the contacts in your mapWEIGHT472=0.001272264631043257A weight value for a given contact, by default is 1ATOMS473=84,2746the atoms involved in each of the contacts you wish to calculateSWITCH473={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5498915910720825}The switching functions to use for each of the contacts in your mapWEIGHT473=0.001272264631043257A weight value for a given contact, by default is 1ATOMS474=84,2748the atoms involved in each of the contacts you wish to calculateSWITCH474={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3995659649372101}The switching functions to use for each of the contacts in your mapWEIGHT474=0.001272264631043257A weight value for a given contact, by default is 1ATOMS475=84,2751the atoms involved in each of the contacts you wish to calculateSWITCH475={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3625049293041229}The switching functions to use for each of the contacts in your mapWEIGHT475=0.001272264631043257A weight value for a given contact, by default is 1ATOMS476=84,2754the atoms involved in each of the contacts you wish to calculateSWITCH476={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48111751675605774}The switching functions to use for each of the contacts in your mapWEIGHT476=0.001272264631043257A weight value for a given contact, by default is 1ATOMS477=84,2757the atoms involved in each of the contacts you wish to calculateSWITCH477={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5383992195129395}The switching functions to use for each of the contacts in your mapWEIGHT477=0.001272264631043257A weight value for a given contact, by default is 1ATOMS478=86,138the atoms involved in each of the contacts you wish to calculateSWITCH478={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5847785472869873}The switching functions to use for each of the contacts in your mapWEIGHT478=0.001272264631043257A weight value for a given contact, by default is 1ATOMS479=86,140the atoms involved in each of the contacts you wish to calculateSWITCH479={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5919957160949707}The switching functions to use for each of the contacts in your mapWEIGHT479=0.001272264631043257A weight value for a given contact, by default is 1ATOMS480=86,142the atoms involved in each of the contacts you wish to calculateSWITCH480={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.46931782364845276}The switching functions to use for each of the contacts in your mapWEIGHT480=0.001272264631043257A weight value for a given contact, by default is 1ATOMS481=86,145the atoms involved in each of the contacts you wish to calculateSWITCH481={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4112861454486847}The switching functions to use for each of the contacts in your mapWEIGHT481=0.001272264631043257A weight value for a given contact, by default is 1ATOMS482=86,148the atoms involved in each of the contacts you wish to calculateSWITCH482={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5670715570449829}The switching functions to use for each of the contacts in your mapWEIGHT482=0.001272264631043257A weight value for a given contact, by default is 1ATOMS483=86,149the atoms involved in each of the contacts you wish to calculateSWITCH483={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.555720329284668}The switching functions to use for each of the contacts in your mapWEIGHT483=0.001272264631043257A weight value for a given contact, by default is 1ATOMS484=86,171the atoms involved in each of the contacts you wish to calculateSWITCH484={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5895600318908691}The switching functions to use for each of the contacts in your mapWEIGHT484=0.001272264631043257A weight value for a given contact, by default is 1ATOMS485=86,2670the atoms involved in each of the contacts you wish to calculateSWITCH485={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5786440372467041}The switching functions to use for each of the contacts in your mapWEIGHT485=0.001272264631043257A weight value for a given contact, by default is 1ATOMS486=86,2672the atoms involved in each of the contacts you wish to calculateSWITCH486={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4714941680431366}The switching functions to use for each of the contacts in your mapWEIGHT486=0.001272264631043257A weight value for a given contact, by default is 1ATOMS487=86,2675the atoms involved in each of the contacts you wish to calculateSWITCH487={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5553250312805176}The switching functions to use for each of the contacts in your mapWEIGHT487=0.001272264631043257A weight value for a given contact, by default is 1ATOMS488=86,2680the atoms involved in each of the contacts you wish to calculateSWITCH488={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.561893880367279}The switching functions to use for each of the contacts in your mapWEIGHT488=0.001272264631043257A weight value for a given contact, by default is 1ATOMS489=86,2683the atoms involved in each of the contacts you wish to calculateSWITCH489={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5445921421051025}The switching functions to use for each of the contacts in your mapWEIGHT489=0.001272264631043257A weight value for a given contact, by default is 1ATOMS490=86,2684the atoms involved in each of the contacts you wish to calculateSWITCH490={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5443058013916016}The switching functions to use for each of the contacts in your mapWEIGHT490=0.001272264631043257A weight value for a given contact, by default is 1ATOMS491=86,2685the atoms involved in each of the contacts you wish to calculateSWITCH491={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5655555129051208}The switching functions to use for each of the contacts in your mapWEIGHT491=0.001272264631043257A weight value for a given contact, by default is 1ATOMS492=86,2687the atoms involved in each of the contacts you wish to calculateSWITCH492={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5737917423248291}The switching functions to use for each of the contacts in your mapWEIGHT492=0.001272264631043257A weight value for a given contact, by default is 1ATOMS493=86,2748the atoms involved in each of the contacts you wish to calculateSWITCH493={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5647324323654175}The switching functions to use for each of the contacts in your mapWEIGHT493=0.001272264631043257A weight value for a given contact, by default is 1ATOMS494=86,2751the atoms involved in each of the contacts you wish to calculateSWITCH494={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4331231713294983}The switching functions to use for each of the contacts in your mapWEIGHT494=0.001272264631043257A weight value for a given contact, by default is 1ATOMS495=86,2754the atoms involved in each of the contacts you wish to calculateSWITCH495={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4529457986354828}The switching functions to use for each of the contacts in your mapWEIGHT495=0.001272264631043257A weight value for a given contact, by default is 1ATOMS496=86,2757the atoms involved in each of the contacts you wish to calculateSWITCH496={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.40369004011154175}The switching functions to use for each of the contacts in your mapWEIGHT496=0.001272264631043257A weight value for a given contact, by default is 1ATOMS497=86,2760the atoms involved in each of the contacts you wish to calculateSWITCH497={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5116841793060303}The switching functions to use for each of the contacts in your mapWEIGHT497=0.001272264631043257A weight value for a given contact, by default is 1ATOMS498=88,140the atoms involved in each of the contacts you wish to calculateSWITCH498={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5784699320793152}The switching functions to use for each of the contacts in your mapWEIGHT498=0.001272264631043257A weight value for a given contact, by default is 1ATOMS499=88,142the atoms involved in each of the contacts you wish to calculateSWITCH499={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.43813228607177734}The switching functions to use for each of the contacts in your mapWEIGHT499=0.001272264631043257A weight value for a given contact, by default is 1ATOMS500=88,145the atoms involved in each of the contacts you wish to calculateSWITCH500={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3675037920475006}The switching functions to use for each of the contacts in your mapWEIGHT500=0.001272264631043257A weight value for a given contact, by default is 1ATOMS501=88,148the atoms involved in each of the contacts you wish to calculateSWITCH501={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5040047764778137}The switching functions to use for each of the contacts in your mapWEIGHT501=0.001272264631043257A weight value for a given contact, by default is 1ATOMS502=88,149the atoms involved in each of the contacts you wish to calculateSWITCH502={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5073596835136414}The switching functions to use for each of the contacts in your mapWEIGHT502=0.001272264631043257A weight value for a given contact, by default is 1ATOMS503=88,171the atoms involved in each of the contacts you wish to calculateSWITCH503={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5801118612289429}The switching functions to use for each of the contacts in your mapWEIGHT503=0.001272264631043257A weight value for a given contact, by default is 1ATOMS504=88,590the atoms involved in each of the contacts you wish to calculateSWITCH504={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49149349331855774}The switching functions to use for each of the contacts in your mapWEIGHT504=0.001272264631043257A weight value for a given contact, by default is 1ATOMS505=88,2672the atoms involved in each of the contacts you wish to calculateSWITCH505={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5349056124687195}The switching functions to use for each of the contacts in your mapWEIGHT505=0.001272264631043257A weight value for a given contact, by default is 1ATOMS506=88,2683the atoms involved in each of the contacts you wish to calculateSWITCH506={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.547234833240509}The switching functions to use for each of the contacts in your mapWEIGHT506=0.001272264631043257A weight value for a given contact, by default is 1ATOMS507=88,2684the atoms involved in each of the contacts you wish to calculateSWITCH507={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5313664078712463}The switching functions to use for each of the contacts in your mapWEIGHT507=0.001272264631043257A weight value for a given contact, by default is 1ATOMS508=88,2685the atoms involved in each of the contacts you wish to calculateSWITCH508={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.553257942199707}The switching functions to use for each of the contacts in your mapWEIGHT508=0.001272264631043257A weight value for a given contact, by default is 1ATOMS509=88,2687the atoms involved in each of the contacts you wish to calculateSWITCH509={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5274791717529297}The switching functions to use for each of the contacts in your mapWEIGHT509=0.001272264631043257A weight value for a given contact, by default is 1ATOMS510=88,2689the atoms involved in each of the contacts you wish to calculateSWITCH510={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.599891722202301}The switching functions to use for each of the contacts in your mapWEIGHT510=0.001272264631043257A weight value for a given contact, by default is 1ATOMS511=88,2692the atoms involved in each of the contacts you wish to calculateSWITCH511={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5785033106803894}The switching functions to use for each of the contacts in your mapWEIGHT511=0.001272264631043257A weight value for a given contact, by default is 1ATOMS512=88,2695the atoms involved in each of the contacts you wish to calculateSWITCH512={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.580222487449646}The switching functions to use for each of the contacts in your mapWEIGHT512=0.001272264631043257A weight value for a given contact, by default is 1ATOMS513=88,2698the atoms involved in each of the contacts you wish to calculateSWITCH513={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5632504224777222}The switching functions to use for each of the contacts in your mapWEIGHT513=0.001272264631043257A weight value for a given contact, by default is 1ATOMS514=88,2748the atoms involved in each of the contacts you wish to calculateSWITCH514={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.47051045298576355}The switching functions to use for each of the contacts in your mapWEIGHT514=0.001272264631043257A weight value for a given contact, by default is 1ATOMS515=88,2751the atoms involved in each of the contacts you wish to calculateSWITCH515={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3613017797470093}The switching functions to use for each of the contacts in your mapWEIGHT515=0.001272264631043257A weight value for a given contact, by default is 1ATOMS516=88,2754the atoms involved in each of the contacts you wish to calculateSWITCH516={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4116445481777191}The switching functions to use for each of the contacts in your mapWEIGHT516=0.001272264631043257A weight value for a given contact, by default is 1ATOMS517=88,2757the atoms involved in each of the contacts you wish to calculateSWITCH517={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.41064453125}The switching functions to use for each of the contacts in your mapWEIGHT517=0.001272264631043257A weight value for a given contact, by default is 1ATOMS518=88,2760the atoms involved in each of the contacts you wish to calculateSWITCH518={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5283654928207397}The switching functions to use for each of the contacts in your mapWEIGHT518=0.001272264631043257A weight value for a given contact, by default is 1ATOMS519=90,138the atoms involved in each of the contacts you wish to calculateSWITCH519={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4243747293949127}The switching functions to use for each of the contacts in your mapWEIGHT519=0.001272264631043257A weight value for a given contact, by default is 1ATOMS520=90,140the atoms involved in each of the contacts you wish to calculateSWITCH520={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5021840929985046}The switching functions to use for each of the contacts in your mapWEIGHT520=0.001272264631043257A weight value for a given contact, by default is 1ATOMS521=90,142the atoms involved in each of the contacts you wish to calculateSWITCH521={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.45640888810157776}The switching functions to use for each of the contacts in your mapWEIGHT521=0.001272264631043257A weight value for a given contact, by default is 1ATOMS522=90,145the atoms involved in each of the contacts you wish to calculateSWITCH522={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4445964992046356}The switching functions to use for each of the contacts in your mapWEIGHT522=0.001272264631043257A weight value for a given contact, by default is 1ATOMS523=90,149the atoms involved in each of the contacts you wish to calculateSWITCH523={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5974119305610657}The switching functions to use for each of the contacts in your mapWEIGHT523=0.001272264631043257A weight value for a given contact, by default is 1ATOMS524=90,153the atoms involved in each of the contacts you wish to calculateSWITCH524={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5916438102722168}The switching functions to use for each of the contacts in your mapWEIGHT524=0.001272264631043257A weight value for a given contact, by default is 1ATOMS525=90,155the atoms involved in each of the contacts you wish to calculateSWITCH525={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.570597231388092}The switching functions to use for each of the contacts in your mapWEIGHT525=0.001272264631043257A weight value for a given contact, by default is 1ATOMS526=90,2627the atoms involved in each of the contacts you wish to calculateSWITCH526={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5549215078353882}The switching functions to use for each of the contacts in your mapWEIGHT526=0.001272264631043257A weight value for a given contact, by default is 1ATOMS527=91,138the atoms involved in each of the contacts you wish to calculateSWITCH527={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3081962466239929}The switching functions to use for each of the contacts in your mapWEIGHT527=0.001272264631043257A weight value for a given contact, by default is 1ATOMS528=91,140the atoms involved in each of the contacts you wish to calculateSWITCH528={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3824211061000824}The switching functions to use for each of the contacts in your mapWEIGHT528=0.001272264631043257A weight value for a given contact, by default is 1ATOMS529=91,142the atoms involved in each of the contacts you wish to calculateSWITCH529={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3445199429988861}The switching functions to use for each of the contacts in your mapWEIGHT529=0.001272264631043257A weight value for a given contact, by default is 1ATOMS530=91,145the atoms involved in each of the contacts you wish to calculateSWITCH530={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.33717793226242065}The switching functions to use for each of the contacts in your mapWEIGHT530=0.001272264631043257A weight value for a given contact, by default is 1ATOMS531=91,148the atoms involved in each of the contacts you wish to calculateSWITCH531={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49571865797042847}The switching functions to use for each of the contacts in your mapWEIGHT531=0.001272264631043257A weight value for a given contact, by default is 1ATOMS532=91,149the atoms involved in each of the contacts you wish to calculateSWITCH532={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5042459964752197}The switching functions to use for each of the contacts in your mapWEIGHT532=0.001272264631043257A weight value for a given contact, by default is 1ATOMS533=91,153the atoms involved in each of the contacts you wish to calculateSWITCH533={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48180630803108215}The switching functions to use for each of the contacts in your mapWEIGHT533=0.001272264631043257A weight value for a given contact, by default is 1ATOMS534=91,154the atoms involved in each of the contacts you wish to calculateSWITCH534={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5948377847671509}The switching functions to use for each of the contacts in your mapWEIGHT534=0.001272264631043257A weight value for a given contact, by default is 1ATOMS535=91,155the atoms involved in each of the contacts you wish to calculateSWITCH535={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.47700121998786926}The switching functions to use for each of the contacts in your mapWEIGHT535=0.001272264631043257A weight value for a given contact, by default is 1ATOMS536=91,171the atoms involved in each of the contacts you wish to calculateSWITCH536={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5943348407745361}The switching functions to use for each of the contacts in your mapWEIGHT536=0.001272264631043257A weight value for a given contact, by default is 1ATOMS537=91,2627the atoms involved in each of the contacts you wish to calculateSWITCH537={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5745858550071716}The switching functions to use for each of the contacts in your mapWEIGHT537=0.001272264631043257A weight value for a given contact, by default is 1ATOMS538=92,155the atoms involved in each of the contacts you wish to calculateSWITCH538={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5790080428123474}The switching functions to use for each of the contacts in your mapWEIGHT538=0.001272264631043257A weight value for a given contact, by default is 1ATOMS539=92,171the atoms involved in each of the contacts you wish to calculateSWITCH539={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5746477842330933}The switching functions to use for each of the contacts in your mapWEIGHT539=0.001272264631043257A weight value for a given contact, by default is 1ATOMS540=94,155the atoms involved in each of the contacts you wish to calculateSWITCH540={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4843006730079651}The switching functions to use for each of the contacts in your mapWEIGHT540=0.001272264631043257A weight value for a given contact, by default is 1ATOMS541=94,157the atoms involved in each of the contacts you wish to calculateSWITCH541={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5622499585151672}The switching functions to use for each of the contacts in your mapWEIGHT541=0.001272264631043257A weight value for a given contact, by default is 1ATOMS542=94,159the atoms involved in each of the contacts you wish to calculateSWITCH542={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5243215560913086}The switching functions to use for each of the contacts in your mapWEIGHT542=0.001272264631043257A weight value for a given contact, by default is 1ATOMS543=94,165the atoms involved in each of the contacts you wish to calculateSWITCH543={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5999416708946228}The switching functions to use for each of the contacts in your mapWEIGHT543=0.001272264631043257A weight value for a given contact, by default is 1ATOMS544=94,168the atoms involved in each of the contacts you wish to calculateSWITCH544={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5529745817184448}The switching functions to use for each of the contacts in your mapWEIGHT544=0.001272264631043257A weight value for a given contact, by default is 1ATOMS545=94,170the atoms involved in each of the contacts you wish to calculateSWITCH545={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4922621250152588}The switching functions to use for each of the contacts in your mapWEIGHT545=0.001272264631043257A weight value for a given contact, by default is 1ATOMS546=94,171the atoms involved in each of the contacts you wish to calculateSWITCH546={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.45928311347961426}The switching functions to use for each of the contacts in your mapWEIGHT546=0.001272264631043257A weight value for a given contact, by default is 1ATOMS547=94,174the atoms involved in each of the contacts you wish to calculateSWITCH547={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5119433403015137}The switching functions to use for each of the contacts in your mapWEIGHT547=0.001272264631043257A weight value for a given contact, by default is 1ATOMS548=96,155the atoms involved in each of the contacts you wish to calculateSWITCH548={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5784645080566406}The switching functions to use for each of the contacts in your mapWEIGHT548=0.001272264631043257A weight value for a given contact, by default is 1ATOMS549=96,159the atoms involved in each of the contacts you wish to calculateSWITCH549={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5526999235153198}The switching functions to use for each of the contacts in your mapWEIGHT549=0.001272264631043257A weight value for a given contact, by default is 1ATOMS550=96,168the atoms involved in each of the contacts you wish to calculateSWITCH550={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5265917778015137}The switching functions to use for each of the contacts in your mapWEIGHT550=0.001272264631043257A weight value for a given contact, by default is 1ATOMS551=96,170the atoms involved in each of the contacts you wish to calculateSWITCH551={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4661823809146881}The switching functions to use for each of the contacts in your mapWEIGHT551=0.001272264631043257A weight value for a given contact, by default is 1ATOMS552=96,171the atoms involved in each of the contacts you wish to calculateSWITCH552={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4726616144180298}The switching functions to use for each of the contacts in your mapWEIGHT552=0.001272264631043257A weight value for a given contact, by default is 1ATOMS553=96,174the atoms involved in each of the contacts you wish to calculateSWITCH553={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4499933421611786}The switching functions to use for each of the contacts in your mapWEIGHT553=0.001272264631043257A weight value for a given contact, by default is 1ATOMS554=99,168the atoms involved in each of the contacts you wish to calculateSWITCH554={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5757662057876587}The switching functions to use for each of the contacts in your mapWEIGHT554=0.001272264631043257A weight value for a given contact, by default is 1ATOMS555=99,170the atoms involved in each of the contacts you wish to calculateSWITCH555={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4870009124279022}The switching functions to use for each of the contacts in your mapWEIGHT555=0.001272264631043257A weight value for a given contact, by default is 1ATOMS556=99,171the atoms involved in each of the contacts you wish to calculateSWITCH556={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.491630882024765}The switching functions to use for each of the contacts in your mapWEIGHT556=0.001272264631043257A weight value for a given contact, by default is 1ATOMS557=99,174the atoms involved in each of the contacts you wish to calculateSWITCH557={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4352952837944031}The switching functions to use for each of the contacts in your mapWEIGHT557=0.001272264631043257A weight value for a given contact, by default is 1ATOMS558=102,168the atoms involved in each of the contacts you wish to calculateSWITCH558={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49716469645500183}The switching functions to use for each of the contacts in your mapWEIGHT558=0.001272264631043257A weight value for a given contact, by default is 1ATOMS559=102,170the atoms involved in each of the contacts you wish to calculateSWITCH559={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.38504528999328613}The switching functions to use for each of the contacts in your mapWEIGHT559=0.001272264631043257A weight value for a given contact, by default is 1ATOMS560=102,171the atoms involved in each of the contacts you wish to calculateSWITCH560={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.37644773721694946}The switching functions to use for each of the contacts in your mapWEIGHT560=0.001272264631043257A weight value for a given contact, by default is 1ATOMS561=102,174the atoms involved in each of the contacts you wish to calculateSWITCH561={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3296087980270386}The switching functions to use for each of the contacts in your mapWEIGHT561=0.001272264631043257A weight value for a given contact, by default is 1ATOMS562=102,2757the atoms involved in each of the contacts you wish to calculateSWITCH562={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5824377536773682}The switching functions to use for each of the contacts in your mapWEIGHT562=0.001272264631043257A weight value for a given contact, by default is 1ATOMS563=103,165the atoms involved in each of the contacts you wish to calculateSWITCH563={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.571112871170044}The switching functions to use for each of the contacts in your mapWEIGHT563=0.001272264631043257A weight value for a given contact, by default is 1ATOMS564=103,168the atoms involved in each of the contacts you wish to calculateSWITCH564={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49017825722694397}The switching functions to use for each of the contacts in your mapWEIGHT564=0.001272264631043257A weight value for a given contact, by default is 1ATOMS565=103,170the atoms involved in each of the contacts you wish to calculateSWITCH565={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3726847171783447}The switching functions to use for each of the contacts in your mapWEIGHT565=0.001272264631043257A weight value for a given contact, by default is 1ATOMS566=103,171the atoms involved in each of the contacts you wish to calculateSWITCH566={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.32049480080604553}The switching functions to use for each of the contacts in your mapWEIGHT566=0.001272264631043257A weight value for a given contact, by default is 1ATOMS567=103,174the atoms involved in each of the contacts you wish to calculateSWITCH567={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.35675477981567383}The switching functions to use for each of the contacts in your mapWEIGHT567=0.001272264631043257A weight value for a given contact, by default is 1ATOMS568=103,2754the atoms involved in each of the contacts you wish to calculateSWITCH568={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5845682621002197}The switching functions to use for each of the contacts in your mapWEIGHT568=0.001272264631043257A weight value for a given contact, by default is 1ATOMS569=103,2757the atoms involved in each of the contacts you wish to calculateSWITCH569={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5356993079185486}The switching functions to use for each of the contacts in your mapWEIGHT569=0.001272264631043257A weight value for a given contact, by default is 1ATOMS570=104,168the atoms involved in each of the contacts you wish to calculateSWITCH570={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48746052384376526}The switching functions to use for each of the contacts in your mapWEIGHT570=0.001272264631043257A weight value for a given contact, by default is 1ATOMS571=104,170the atoms involved in each of the contacts you wish to calculateSWITCH571={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.37119659781455994}The switching functions to use for each of the contacts in your mapWEIGHT571=0.001272264631043257A weight value for a given contact, by default is 1ATOMS572=104,171the atoms involved in each of the contacts you wish to calculateSWITCH572={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.39011022448539734}The switching functions to use for each of the contacts in your mapWEIGHT572=0.001272264631043257A weight value for a given contact, by default is 1ATOMS573=104,174the atoms involved in each of the contacts you wish to calculateSWITCH573={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.2769278585910797}The switching functions to use for each of the contacts in your mapWEIGHT573=0.001272264631043257A weight value for a given contact, by default is 1ATOMS574=105,155the atoms involved in each of the contacts you wish to calculateSWITCH574={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3936966359615326}The switching functions to use for each of the contacts in your mapWEIGHT574=0.001272264631043257A weight value for a given contact, by default is 1ATOMS575=105,157the atoms involved in each of the contacts you wish to calculateSWITCH575={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.47846728563308716}The switching functions to use for each of the contacts in your mapWEIGHT575=0.001272264631043257A weight value for a given contact, by default is 1ATOMS576=105,159the atoms involved in each of the contacts you wish to calculateSWITCH576={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44442665576934814}The switching functions to use for each of the contacts in your mapWEIGHT576=0.001272264631043257A weight value for a given contact, by default is 1ATOMS577=105,162the atoms involved in each of the contacts you wish to calculateSWITCH577={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5618299245834351}The switching functions to use for each of the contacts in your mapWEIGHT577=0.001272264631043257A weight value for a given contact, by default is 1ATOMS578=105,165the atoms involved in each of the contacts you wish to calculateSWITCH578={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5813999176025391}The switching functions to use for each of the contacts in your mapWEIGHT578=0.001272264631043257A weight value for a given contact, by default is 1ATOMS579=105,168the atoms involved in each of the contacts you wish to calculateSWITCH579={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5617444515228271}The switching functions to use for each of the contacts in your mapWEIGHT579=0.001272264631043257A weight value for a given contact, by default is 1ATOMS580=105,170the atoms involved in each of the contacts you wish to calculateSWITCH580={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5358394384384155}The switching functions to use for each of the contacts in your mapWEIGHT580=0.001272264631043257A weight value for a given contact, by default is 1ATOMS581=105,171the atoms involved in each of the contacts you wish to calculateSWITCH581={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5119461417198181}The switching functions to use for each of the contacts in your mapWEIGHT581=0.001272264631043257A weight value for a given contact, by default is 1ATOMS582=105,174the atoms involved in each of the contacts you wish to calculateSWITCH582={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5792010426521301}The switching functions to use for each of the contacts in your mapWEIGHT582=0.001272264631043257A weight value for a given contact, by default is 1ATOMS583=105,177the atoms involved in each of the contacts you wish to calculateSWITCH583={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5971757769584656}The switching functions to use for each of the contacts in your mapWEIGHT583=0.001272264631043257A weight value for a given contact, by default is 1ATOMS584=106,155the atoms involved in each of the contacts you wish to calculateSWITCH584={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.2777823805809021}The switching functions to use for each of the contacts in your mapWEIGHT584=0.001272264631043257A weight value for a given contact, by default is 1ATOMS585=106,157the atoms involved in each of the contacts you wish to calculateSWITCH585={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.35657399892807007}The switching functions to use for each of the contacts in your mapWEIGHT585=0.001272264631043257A weight value for a given contact, by default is 1ATOMS586=106,159the atoms involved in each of the contacts you wish to calculateSWITCH586={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3310907185077667}The switching functions to use for each of the contacts in your mapWEIGHT586=0.001272264631043257A weight value for a given contact, by default is 1ATOMS587=106,162the atoms involved in each of the contacts you wish to calculateSWITCH587={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4581385850906372}The switching functions to use for each of the contacts in your mapWEIGHT587=0.001272264631043257A weight value for a given contact, by default is 1ATOMS588=106,165the atoms involved in each of the contacts you wish to calculateSWITCH588={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48814958333969116}The switching functions to use for each of the contacts in your mapWEIGHT588=0.001272264631043257A weight value for a given contact, by default is 1ATOMS589=106,168the atoms involved in each of the contacts you wish to calculateSWITCH589={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4935433566570282}The switching functions to use for each of the contacts in your mapWEIGHT589=0.001272264631043257A weight value for a given contact, by default is 1ATOMS590=106,170the atoms involved in each of the contacts you wish to calculateSWITCH590={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4893241226673126}The switching functions to use for each of the contacts in your mapWEIGHT590=0.001272264631043257A weight value for a given contact, by default is 1ATOMS591=106,171the atoms involved in each of the contacts you wish to calculateSWITCH591={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.465021550655365}The switching functions to use for each of the contacts in your mapWEIGHT591=0.001272264631043257A weight value for a given contact, by default is 1ATOMS592=106,174the atoms involved in each of the contacts you wish to calculateSWITCH592={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5579372644424438}The switching functions to use for each of the contacts in your mapWEIGHT592=0.001272264631043257A weight value for a given contact, by default is 1ATOMS593=106,177the atoms involved in each of the contacts you wish to calculateSWITCH593={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4753956198692322}The switching functions to use for each of the contacts in your mapWEIGHT593=0.001272264631043257A weight value for a given contact, by default is 1ATOMS594=106,178the atoms involved in each of the contacts you wish to calculateSWITCH594={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49455469846725464}The switching functions to use for each of the contacts in your mapWEIGHT594=0.001272264631043257A weight value for a given contact, by default is 1ATOMS595=106,179the atoms involved in each of the contacts you wish to calculateSWITCH595={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5882182717323303}The switching functions to use for each of the contacts in your mapWEIGHT595=0.001272264631043257A weight value for a given contact, by default is 1ATOMS596=107,2489the atoms involved in each of the contacts you wish to calculateSWITCH596={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5789481401443481}The switching functions to use for each of the contacts in your mapWEIGHT596=0.001272264631043257A weight value for a given contact, by default is 1ATOMS597=107,2493the atoms involved in each of the contacts you wish to calculateSWITCH597={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5983418226242065}The switching functions to use for each of the contacts in your mapWEIGHT597=0.001272264631043257A weight value for a given contact, by default is 1ATOMS598=109,2472the atoms involved in each of the contacts you wish to calculateSWITCH598={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5220774412155151}The switching functions to use for each of the contacts in your mapWEIGHT598=0.001272264631043257A weight value for a given contact, by default is 1ATOMS599=109,2489the atoms involved in each of the contacts you wish to calculateSWITCH599={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49669909477233887}The switching functions to use for each of the contacts in your mapWEIGHT599=0.001272264631043257A weight value for a given contact, by default is 1ATOMS600=109,2493the atoms involved in each of the contacts you wish to calculateSWITCH600={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5393236875534058}The switching functions to use for each of the contacts in your mapWEIGHT600=0.001272264631043257A weight value for a given contact, by default is 1ATOMS601=111,2472the atoms involved in each of the contacts you wish to calculateSWITCH601={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49834689497947693}The switching functions to use for each of the contacts in your mapWEIGHT601=0.001272264631043257A weight value for a given contact, by default is 1ATOMS602=111,2487the atoms involved in each of the contacts you wish to calculateSWITCH602={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5349353551864624}The switching functions to use for each of the contacts in your mapWEIGHT602=0.001272264631043257A weight value for a given contact, by default is 1ATOMS603=111,2489the atoms involved in each of the contacts you wish to calculateSWITCH603={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.41478776931762695}The switching functions to use for each of the contacts in your mapWEIGHT603=0.001272264631043257A weight value for a given contact, by default is 1ATOMS604=111,2491the atoms involved in each of the contacts you wish to calculateSWITCH604={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5678739547729492}The switching functions to use for each of the contacts in your mapWEIGHT604=0.001272264631043257A weight value for a given contact, by default is 1ATOMS605=111,2493the atoms involved in each of the contacts you wish to calculateSWITCH605={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.43599191308021545}The switching functions to use for each of the contacts in your mapWEIGHT605=0.001272264631043257A weight value for a given contact, by default is 1ATOMS606=114,2466the atoms involved in each of the contacts you wish to calculateSWITCH606={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5594121217727661}The switching functions to use for each of the contacts in your mapWEIGHT606=0.001272264631043257A weight value for a given contact, by default is 1ATOMS607=114,2468the atoms involved in each of the contacts you wish to calculateSWITCH607={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5172153115272522}The switching functions to use for each of the contacts in your mapWEIGHT607=0.001272264631043257A weight value for a given contact, by default is 1ATOMS608=114,2472the atoms involved in each of the contacts you wish to calculateSWITCH608={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.39070579409599304}The switching functions to use for each of the contacts in your mapWEIGHT608=0.001272264631043257A weight value for a given contact, by default is 1ATOMS609=114,2487the atoms involved in each of the contacts you wish to calculateSWITCH609={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5118759870529175}The switching functions to use for each of the contacts in your mapWEIGHT609=0.001272264631043257A weight value for a given contact, by default is 1ATOMS610=114,2489the atoms involved in each of the contacts you wish to calculateSWITCH610={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.41589900851249695}The switching functions to use for each of the contacts in your mapWEIGHT610=0.001272264631043257A weight value for a given contact, by default is 1ATOMS611=114,2491the atoms involved in each of the contacts you wish to calculateSWITCH611={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.580029308795929}The switching functions to use for each of the contacts in your mapWEIGHT611=0.001272264631043257A weight value for a given contact, by default is 1ATOMS612=114,2493the atoms involved in each of the contacts you wish to calculateSWITCH612={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4583949148654938}The switching functions to use for each of the contacts in your mapWEIGHT612=0.001272264631043257A weight value for a given contact, by default is 1ATOMS613=115,2466the atoms involved in each of the contacts you wish to calculateSWITCH613={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49345827102661133}The switching functions to use for each of the contacts in your mapWEIGHT613=0.001272264631043257A weight value for a given contact, by default is 1ATOMS614=115,2468the atoms involved in each of the contacts you wish to calculateSWITCH614={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.42680782079696655}The switching functions to use for each of the contacts in your mapWEIGHT614=0.001272264631043257A weight value for a given contact, by default is 1ATOMS615=115,2469the atoms involved in each of the contacts you wish to calculateSWITCH615={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.522367537021637}The switching functions to use for each of the contacts in your mapWEIGHT615=0.001272264631043257A weight value for a given contact, by default is 1ATOMS616=115,2472the atoms involved in each of the contacts you wish to calculateSWITCH616={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.2924553155899048}The switching functions to use for each of the contacts in your mapWEIGHT616=0.001272264631043257A weight value for a given contact, by default is 1ATOMS617=115,2487the atoms involved in each of the contacts you wish to calculateSWITCH617={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5158274173736572}The switching functions to use for each of the contacts in your mapWEIGHT617=0.001272264631043257A weight value for a given contact, by default is 1ATOMS618=115,2489the atoms involved in each of the contacts you wish to calculateSWITCH618={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44396498799324036}The switching functions to use for each of the contacts in your mapWEIGHT618=0.001272264631043257A weight value for a given contact, by default is 1ATOMS619=115,2493the atoms involved in each of the contacts you wish to calculateSWITCH619={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5182554721832275}The switching functions to use for each of the contacts in your mapWEIGHT619=0.001272264631043257A weight value for a given contact, by default is 1ATOMS620=116,2466the atoms involved in each of the contacts you wish to calculateSWITCH620={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5777896046638489}The switching functions to use for each of the contacts in your mapWEIGHT620=0.001272264631043257A weight value for a given contact, by default is 1ATOMS621=116,2468the atoms involved in each of the contacts you wish to calculateSWITCH621={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.557919979095459}The switching functions to use for each of the contacts in your mapWEIGHT621=0.001272264631043257A weight value for a given contact, by default is 1ATOMS622=116,2472the atoms involved in each of the contacts you wish to calculateSWITCH622={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4431975185871124}The switching functions to use for each of the contacts in your mapWEIGHT622=0.001272264631043257A weight value for a given contact, by default is 1ATOMS623=116,2476the atoms involved in each of the contacts you wish to calculateSWITCH623={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5856500267982483}The switching functions to use for each of the contacts in your mapWEIGHT623=0.001272264631043257A weight value for a given contact, by default is 1ATOMS624=116,2487the atoms involved in each of the contacts you wish to calculateSWITCH624={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5392717719078064}The switching functions to use for each of the contacts in your mapWEIGHT624=0.001272264631043257A weight value for a given contact, by default is 1ATOMS625=116,2489the atoms involved in each of the contacts you wish to calculateSWITCH625={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44796767830848694}The switching functions to use for each of the contacts in your mapWEIGHT625=0.001272264631043257A weight value for a given contact, by default is 1ATOMS626=116,2491the atoms involved in each of the contacts you wish to calculateSWITCH626={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5705269575119019}The switching functions to use for each of the contacts in your mapWEIGHT626=0.001272264631043257A weight value for a given contact, by default is 1ATOMS627=116,2493the atoms involved in each of the contacts you wish to calculateSWITCH627={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.46698707342147827}The switching functions to use for each of the contacts in your mapWEIGHT627=0.001272264631043257A weight value for a given contact, by default is 1ATOMS628=117,2468the atoms involved in each of the contacts you wish to calculateSWITCH628={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5794000029563904}The switching functions to use for each of the contacts in your mapWEIGHT628=0.001272264631043257A weight value for a given contact, by default is 1ATOMS629=117,2472the atoms involved in each of the contacts you wish to calculateSWITCH629={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4666624069213867}The switching functions to use for each of the contacts in your mapWEIGHT629=0.001272264631043257A weight value for a given contact, by default is 1ATOMS630=117,2487the atoms involved in each of the contacts you wish to calculateSWITCH630={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5343987345695496}The switching functions to use for each of the contacts in your mapWEIGHT630=0.001272264631043257A weight value for a given contact, by default is 1ATOMS631=117,2489the atoms involved in each of the contacts you wish to calculateSWITCH631={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44154852628707886}The switching functions to use for each of the contacts in your mapWEIGHT631=0.001272264631043257A weight value for a given contact, by default is 1ATOMS632=117,2493the atoms involved in each of the contacts you wish to calculateSWITCH632={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5117276310920715}The switching functions to use for each of the contacts in your mapWEIGHT632=0.001272264631043257A weight value for a given contact, by default is 1ATOMS633=118,179the atoms involved in each of the contacts you wish to calculateSWITCH633={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5948761105537415}The switching functions to use for each of the contacts in your mapWEIGHT633=0.001272264631043257A weight value for a given contact, by default is 1ATOMS634=118,2468the atoms involved in each of the contacts you wish to calculateSWITCH634={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5226342082023621}The switching functions to use for each of the contacts in your mapWEIGHT634=0.001272264631043257A weight value for a given contact, by default is 1ATOMS635=118,2469the atoms involved in each of the contacts you wish to calculateSWITCH635={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5688244700431824}The switching functions to use for each of the contacts in your mapWEIGHT635=0.001272264631043257A weight value for a given contact, by default is 1ATOMS636=118,2472the atoms involved in each of the contacts you wish to calculateSWITCH636={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4147334694862366}The switching functions to use for each of the contacts in your mapWEIGHT636=0.001272264631043257A weight value for a given contact, by default is 1ATOMS637=118,2487the atoms involved in each of the contacts you wish to calculateSWITCH637={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5643527507781982}The switching functions to use for each of the contacts in your mapWEIGHT637=0.001272264631043257A weight value for a given contact, by default is 1ATOMS638=118,2489the atoms involved in each of the contacts you wish to calculateSWITCH638={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.496494859457016}The switching functions to use for each of the contacts in your mapWEIGHT638=0.001272264631043257A weight value for a given contact, by default is 1ATOMS639=118,2493the atoms involved in each of the contacts you wish to calculateSWITCH639={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5889899730682373}The switching functions to use for each of the contacts in your mapWEIGHT639=0.001272264631043257A weight value for a given contact, by default is 1ATOMS640=119,2472the atoms involved in each of the contacts you wish to calculateSWITCH640={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5287625789642334}The switching functions to use for each of the contacts in your mapWEIGHT640=0.001272264631043257A weight value for a given contact, by default is 1ATOMS641=119,2487the atoms involved in each of the contacts you wish to calculateSWITCH641={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4841465950012207}The switching functions to use for each of the contacts in your mapWEIGHT641=0.001272264631043257A weight value for a given contact, by default is 1ATOMS642=119,2489the atoms involved in each of the contacts you wish to calculateSWITCH642={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3875008821487427}The switching functions to use for each of the contacts in your mapWEIGHT642=0.001272264631043257A weight value for a given contact, by default is 1ATOMS643=119,2491the atoms involved in each of the contacts you wish to calculateSWITCH643={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5781373977661133}The switching functions to use for each of the contacts in your mapWEIGHT643=0.001272264631043257A weight value for a given contact, by default is 1ATOMS644=119,2493the atoms involved in each of the contacts you wish to calculateSWITCH644={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4469820559024811}The switching functions to use for each of the contacts in your mapWEIGHT644=0.001272264631043257A weight value for a given contact, by default is 1ATOMS645=121,2472the atoms involved in each of the contacts you wish to calculateSWITCH645={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5315241813659668}The switching functions to use for each of the contacts in your mapWEIGHT645=0.001272264631043257A weight value for a given contact, by default is 1ATOMS646=121,2485the atoms involved in each of the contacts you wish to calculateSWITCH646={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5696990489959717}The switching functions to use for each of the contacts in your mapWEIGHT646=0.001272264631043257A weight value for a given contact, by default is 1ATOMS647=121,2487the atoms involved in each of the contacts you wish to calculateSWITCH647={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4506149888038635}The switching functions to use for each of the contacts in your mapWEIGHT647=0.001272264631043257A weight value for a given contact, by default is 1ATOMS648=121,2489the atoms involved in each of the contacts you wish to calculateSWITCH648={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3882794678211212}The switching functions to use for each of the contacts in your mapWEIGHT648=0.001272264631043257A weight value for a given contact, by default is 1ATOMS649=121,2491the atoms involved in each of the contacts you wish to calculateSWITCH649={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5852476954460144}The switching functions to use for each of the contacts in your mapWEIGHT649=0.001272264631043257A weight value for a given contact, by default is 1ATOMS650=121,2493the atoms involved in each of the contacts you wish to calculateSWITCH650={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.46923863887786865}The switching functions to use for each of the contacts in your mapWEIGHT650=0.001272264631043257A weight value for a given contact, by default is 1ATOMS651=123,701the atoms involved in each of the contacts you wish to calculateSWITCH651={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5456225872039795}The switching functions to use for each of the contacts in your mapWEIGHT651=0.001272264631043257A weight value for a given contact, by default is 1ATOMS652=123,2484the atoms involved in each of the contacts you wish to calculateSWITCH652={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5791321396827698}The switching functions to use for each of the contacts in your mapWEIGHT652=0.001272264631043257A weight value for a given contact, by default is 1ATOMS653=123,2485the atoms involved in each of the contacts you wish to calculateSWITCH653={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5373994708061218}The switching functions to use for each of the contacts in your mapWEIGHT653=0.001272264631043257A weight value for a given contact, by default is 1ATOMS654=123,2487the atoms involved in each of the contacts you wish to calculateSWITCH654={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44423991441726685}The switching functions to use for each of the contacts in your mapWEIGHT654=0.001272264631043257A weight value for a given contact, by default is 1ATOMS655=123,2489the atoms involved in each of the contacts you wish to calculateSWITCH655={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3876829445362091}The switching functions to use for each of the contacts in your mapWEIGHT655=0.001272264631043257A weight value for a given contact, by default is 1ATOMS656=123,2491the atoms involved in each of the contacts you wish to calculateSWITCH656={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5357497930526733}The switching functions to use for each of the contacts in your mapWEIGHT656=0.001272264631043257A weight value for a given contact, by default is 1ATOMS657=123,2493the atoms involved in each of the contacts you wish to calculateSWITCH657={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.441449910402298}The switching functions to use for each of the contacts in your mapWEIGHT657=0.001272264631043257A weight value for a given contact, by default is 1ATOMS658=123,2627the atoms involved in each of the contacts you wish to calculateSWITCH658={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5330907106399536}The switching functions to use for each of the contacts in your mapWEIGHT658=0.001272264631043257A weight value for a given contact, by default is 1ATOMS659=126,630the atoms involved in each of the contacts you wish to calculateSWITCH659={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5642926096916199}The switching functions to use for each of the contacts in your mapWEIGHT659=0.001272264631043257A weight value for a given contact, by default is 1ATOMS660=126,639the atoms involved in each of the contacts you wish to calculateSWITCH660={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5190467238426208}The switching functions to use for each of the contacts in your mapWEIGHT660=0.001272264631043257A weight value for a given contact, by default is 1ATOMS661=126,647the atoms involved in each of the contacts you wish to calculateSWITCH661={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5666074752807617}The switching functions to use for each of the contacts in your mapWEIGHT661=0.001272264631043257A weight value for a given contact, by default is 1ATOMS662=126,699the atoms involved in each of the contacts you wish to calculateSWITCH662={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5293826460838318}The switching functions to use for each of the contacts in your mapWEIGHT662=0.001272264631043257A weight value for a given contact, by default is 1ATOMS663=126,701the atoms involved in each of the contacts you wish to calculateSWITCH663={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.42170247435569763}The switching functions to use for each of the contacts in your mapWEIGHT663=0.001272264631043257A weight value for a given contact, by default is 1ATOMS664=126,703the atoms involved in each of the contacts you wish to calculateSWITCH664={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5110330581665039}The switching functions to use for each of the contacts in your mapWEIGHT664=0.001272264631043257A weight value for a given contact, by default is 1ATOMS665=126,2484the atoms involved in each of the contacts you wish to calculateSWITCH665={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5906072854995728}The switching functions to use for each of the contacts in your mapWEIGHT665=0.001272264631043257A weight value for a given contact, by default is 1ATOMS666=126,2485the atoms involved in each of the contacts you wish to calculateSWITCH666={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5313333868980408}The switching functions to use for each of the contacts in your mapWEIGHT666=0.001272264631043257A weight value for a given contact, by default is 1ATOMS667=126,2487the atoms involved in each of the contacts you wish to calculateSWITCH667={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.455870658159256}The switching functions to use for each of the contacts in your mapWEIGHT667=0.001272264631043257A weight value for a given contact, by default is 1ATOMS668=126,2489the atoms involved in each of the contacts you wish to calculateSWITCH668={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4450112581253052}The switching functions to use for each of the contacts in your mapWEIGHT668=0.001272264631043257A weight value for a given contact, by default is 1ATOMS669=126,2491the atoms involved in each of the contacts you wish to calculateSWITCH669={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5807830095291138}The switching functions to use for each of the contacts in your mapWEIGHT669=0.001272264631043257A weight value for a given contact, by default is 1ATOMS670=126,2493the atoms involved in each of the contacts you wish to calculateSWITCH670={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5123680233955383}The switching functions to use for each of the contacts in your mapWEIGHT670=0.001272264631043257A weight value for a given contact, by default is 1ATOMS671=126,2627the atoms involved in each of the contacts you wish to calculateSWITCH671={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5922099351882935}The switching functions to use for each of the contacts in your mapWEIGHT671=0.001272264631043257A weight value for a given contact, by default is 1ATOMS672=128,639the atoms involved in each of the contacts you wish to calculateSWITCH672={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5221266746520996}The switching functions to use for each of the contacts in your mapWEIGHT672=0.001272264631043257A weight value for a given contact, by default is 1ATOMS673=128,642the atoms involved in each of the contacts you wish to calculateSWITCH673={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5704806447029114}The switching functions to use for each of the contacts in your mapWEIGHT673=0.001272264631043257A weight value for a given contact, by default is 1ATOMS674=128,699the atoms involved in each of the contacts you wish to calculateSWITCH674={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5785180926322937}The switching functions to use for each of the contacts in your mapWEIGHT674=0.001272264631043257A weight value for a given contact, by default is 1ATOMS675=128,701the atoms involved in each of the contacts you wish to calculateSWITCH675={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4796541929244995}The switching functions to use for each of the contacts in your mapWEIGHT675=0.001272264631043257A weight value for a given contact, by default is 1ATOMS676=128,703the atoms involved in each of the contacts you wish to calculateSWITCH676={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5436229705810547}The switching functions to use for each of the contacts in your mapWEIGHT676=0.001272264631043257A weight value for a given contact, by default is 1ATOMS677=128,2466the atoms involved in each of the contacts you wish to calculateSWITCH677={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.593165934085846}The switching functions to use for each of the contacts in your mapWEIGHT677=0.001272264631043257A weight value for a given contact, by default is 1ATOMS678=128,2468the atoms involved in each of the contacts you wish to calculateSWITCH678={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5919168591499329}The switching functions to use for each of the contacts in your mapWEIGHT678=0.001272264631043257A weight value for a given contact, by default is 1ATOMS679=128,2472the atoms involved in each of the contacts you wish to calculateSWITCH679={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5895395874977112}The switching functions to use for each of the contacts in your mapWEIGHT679=0.001272264631043257A weight value for a given contact, by default is 1ATOMS680=128,2484the atoms involved in each of the contacts you wish to calculateSWITCH680={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5013759136199951}The switching functions to use for each of the contacts in your mapWEIGHT680=0.001272264631043257A weight value for a given contact, by default is 1ATOMS681=128,2485the atoms involved in each of the contacts you wish to calculateSWITCH681={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4169052243232727}The switching functions to use for each of the contacts in your mapWEIGHT681=0.001272264631043257A weight value for a given contact, by default is 1ATOMS682=128,2487the atoms involved in each of the contacts you wish to calculateSWITCH682={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3465384542942047}The switching functions to use for each of the contacts in your mapWEIGHT682=0.001272264631043257A weight value for a given contact, by default is 1ATOMS683=128,2489the atoms involved in each of the contacts you wish to calculateSWITCH683={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3778967559337616}The switching functions to use for each of the contacts in your mapWEIGHT683=0.001272264631043257A weight value for a given contact, by default is 1ATOMS684=128,2491the atoms involved in each of the contacts you wish to calculateSWITCH684={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5218582153320312}The switching functions to use for each of the contacts in your mapWEIGHT684=0.001272264631043257A weight value for a given contact, by default is 1ATOMS685=128,2493the atoms involved in each of the contacts you wish to calculateSWITCH685={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.467732697725296}The switching functions to use for each of the contacts in your mapWEIGHT685=0.001272264631043257A weight value for a given contact, by default is 1ATOMS686=128,2579the atoms involved in each of the contacts you wish to calculateSWITCH686={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5743491053581238}The switching functions to use for each of the contacts in your mapWEIGHT686=0.001272264631043257A weight value for a given contact, by default is 1ATOMS687=132,630the atoms involved in each of the contacts you wish to calculateSWITCH687={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.557230532169342}The switching functions to use for each of the contacts in your mapWEIGHT687=0.001272264631043257A weight value for a given contact, by default is 1ATOMS688=132,639the atoms involved in each of the contacts you wish to calculateSWITCH688={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5518144369125366}The switching functions to use for each of the contacts in your mapWEIGHT688=0.001272264631043257A weight value for a given contact, by default is 1ATOMS689=132,646the atoms involved in each of the contacts you wish to calculateSWITCH689={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5439162850379944}The switching functions to use for each of the contacts in your mapWEIGHT689=0.001272264631043257A weight value for a given contact, by default is 1ATOMS690=132,647the atoms involved in each of the contacts you wish to calculateSWITCH690={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4817323386669159}The switching functions to use for each of the contacts in your mapWEIGHT690=0.001272264631043257A weight value for a given contact, by default is 1ATOMS691=132,648the atoms involved in each of the contacts you wish to calculateSWITCH691={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5847914218902588}The switching functions to use for each of the contacts in your mapWEIGHT691=0.001272264631043257A weight value for a given contact, by default is 1ATOMS692=132,650the atoms involved in each of the contacts you wish to calculateSWITCH692={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5656059384346008}The switching functions to use for each of the contacts in your mapWEIGHT692=0.001272264631043257A weight value for a given contact, by default is 1ATOMS693=132,695the atoms involved in each of the contacts you wish to calculateSWITCH693={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5839726328849792}The switching functions to use for each of the contacts in your mapWEIGHT693=0.001272264631043257A weight value for a given contact, by default is 1ATOMS694=132,697the atoms involved in each of the contacts you wish to calculateSWITCH694={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5116190314292908}The switching functions to use for each of the contacts in your mapWEIGHT694=0.001272264631043257A weight value for a given contact, by default is 1ATOMS695=132,699the atoms involved in each of the contacts you wish to calculateSWITCH695={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.38981035351753235}The switching functions to use for each of the contacts in your mapWEIGHT695=0.001272264631043257A weight value for a given contact, by default is 1ATOMS696=132,701the atoms involved in each of the contacts you wish to calculateSWITCH696={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.2981325387954712}The switching functions to use for each of the contacts in your mapWEIGHT696=0.001272264631043257A weight value for a given contact, by default is 1ATOMS697=132,703the atoms involved in each of the contacts you wish to calculateSWITCH697={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3689349889755249}The switching functions to use for each of the contacts in your mapWEIGHT697=0.001272264631043257A weight value for a given contact, by default is 1ATOMS698=132,2485the atoms involved in each of the contacts you wish to calculateSWITCH698={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5833978652954102}The switching functions to use for each of the contacts in your mapWEIGHT698=0.001272264631043257A weight value for a given contact, by default is 1ATOMS699=132,2487the atoms involved in each of the contacts you wish to calculateSWITCH699={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.538625955581665}The switching functions to use for each of the contacts in your mapWEIGHT699=0.001272264631043257A weight value for a given contact, by default is 1ATOMS700=132,2489the atoms involved in each of the contacts you wish to calculateSWITCH700={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5302574634552002}The switching functions to use for each of the contacts in your mapWEIGHT700=0.001272264631043257A weight value for a given contact, by default is 1ATOMS701=132,2493the atoms involved in each of the contacts you wish to calculateSWITCH701={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5676487684249878}The switching functions to use for each of the contacts in your mapWEIGHT701=0.001272264631043257A weight value for a given contact, by default is 1ATOMS702=132,2579the atoms involved in each of the contacts you wish to calculateSWITCH702={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5303641557693481}The switching functions to use for each of the contacts in your mapWEIGHT702=0.001272264631043257A weight value for a given contact, by default is 1ATOMS703=132,2625the atoms involved in each of the contacts you wish to calculateSWITCH703={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5635920763015747}The switching functions to use for each of the contacts in your mapWEIGHT703=0.001272264631043257A weight value for a given contact, by default is 1ATOMS704=132,2627the atoms involved in each of the contacts you wish to calculateSWITCH704={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5122939944267273}The switching functions to use for each of the contacts in your mapWEIGHT704=0.001272264631043257A weight value for a given contact, by default is 1ATOMS705=132,2631the atoms involved in each of the contacts you wish to calculateSWITCH705={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5500911474227905}The switching functions to use for each of the contacts in your mapWEIGHT705=0.001272264631043257A weight value for a given contact, by default is 1ATOMS706=136,630the atoms involved in each of the contacts you wish to calculateSWITCH706={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5960034728050232}The switching functions to use for each of the contacts in your mapWEIGHT706=0.001272264631043257A weight value for a given contact, by default is 1ATOMS707=136,639the atoms involved in each of the contacts you wish to calculateSWITCH707={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5961722731590271}The switching functions to use for each of the contacts in your mapWEIGHT707=0.001272264631043257A weight value for a given contact, by default is 1ATOMS708=136,2487the atoms involved in each of the contacts you wish to calculateSWITCH708={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.583244264125824}The switching functions to use for each of the contacts in your mapWEIGHT708=0.001272264631043257A weight value for a given contact, by default is 1ATOMS709=136,2489the atoms involved in each of the contacts you wish to calculateSWITCH709={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5341731309890747}The switching functions to use for each of the contacts in your mapWEIGHT709=0.001272264631043257A weight value for a given contact, by default is 1ATOMS710=137,630the atoms involved in each of the contacts you wish to calculateSWITCH710={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5356175303459167}The switching functions to use for each of the contacts in your mapWEIGHT710=0.001272264631043257A weight value for a given contact, by default is 1ATOMS711=137,633the atoms involved in each of the contacts you wish to calculateSWITCH711={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5274797677993774}The switching functions to use for each of the contacts in your mapWEIGHT711=0.001272264631043257A weight value for a given contact, by default is 1ATOMS712=137,636the atoms involved in each of the contacts you wish to calculateSWITCH712={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5731673240661621}The switching functions to use for each of the contacts in your mapWEIGHT712=0.001272264631043257A weight value for a given contact, by default is 1ATOMS713=137,639the atoms involved in each of the contacts you wish to calculateSWITCH713={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49891984462738037}The switching functions to use for each of the contacts in your mapWEIGHT713=0.001272264631043257A weight value for a given contact, by default is 1ATOMS714=137,2472the atoms involved in each of the contacts you wish to calculateSWITCH714={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.595513105392456}The switching functions to use for each of the contacts in your mapWEIGHT714=0.001272264631043257A weight value for a given contact, by default is 1ATOMS715=137,2489the atoms involved in each of the contacts you wish to calculateSWITCH715={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5868245959281921}The switching functions to use for each of the contacts in your mapWEIGHT715=0.001272264631043257A weight value for a given contact, by default is 1ATOMS716=140,590the atoms involved in each of the contacts you wish to calculateSWITCH716={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5583635568618774}The switching functions to use for each of the contacts in your mapWEIGHT716=0.001272264631043257A weight value for a given contact, by default is 1ATOMS717=140,630the atoms involved in each of the contacts you wish to calculateSWITCH717={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5547485947608948}The switching functions to use for each of the contacts in your mapWEIGHT717=0.001272264631043257A weight value for a given contact, by default is 1ATOMS718=140,633the atoms involved in each of the contacts you wish to calculateSWITCH718={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5800905227661133}The switching functions to use for each of the contacts in your mapWEIGHT718=0.001272264631043257A weight value for a given contact, by default is 1ATOMS719=142,526the atoms involved in each of the contacts you wish to calculateSWITCH719={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5594255924224854}The switching functions to use for each of the contacts in your mapWEIGHT719=0.001272264631043257A weight value for a given contact, by default is 1ATOMS720=142,584the atoms involved in each of the contacts you wish to calculateSWITCH720={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5549558997154236}The switching functions to use for each of the contacts in your mapWEIGHT720=0.001272264631043257A weight value for a given contact, by default is 1ATOMS721=142,586the atoms involved in each of the contacts you wish to calculateSWITCH721={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5379312038421631}The switching functions to use for each of the contacts in your mapWEIGHT721=0.001272264631043257A weight value for a given contact, by default is 1ATOMS722=142,588the atoms involved in each of the contacts you wish to calculateSWITCH722={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5218092799186707}The switching functions to use for each of the contacts in your mapWEIGHT722=0.001272264631043257A weight value for a given contact, by default is 1ATOMS723=142,590the atoms involved in each of the contacts you wish to calculateSWITCH723={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4539978504180908}The switching functions to use for each of the contacts in your mapWEIGHT723=0.001272264631043257A weight value for a given contact, by default is 1ATOMS724=145,584the atoms involved in each of the contacts you wish to calculateSWITCH724={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5172803997993469}The switching functions to use for each of the contacts in your mapWEIGHT724=0.001272264631043257A weight value for a given contact, by default is 1ATOMS725=145,586the atoms involved in each of the contacts you wish to calculateSWITCH725={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4952909052371979}The switching functions to use for each of the contacts in your mapWEIGHT725=0.001272264631043257A weight value for a given contact, by default is 1ATOMS726=145,588the atoms involved in each of the contacts you wish to calculateSWITCH726={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5163933038711548}The switching functions to use for each of the contacts in your mapWEIGHT726=0.001272264631043257A weight value for a given contact, by default is 1ATOMS727=145,590the atoms involved in each of the contacts you wish to calculateSWITCH727={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3797434866428375}The switching functions to use for each of the contacts in your mapWEIGHT727=0.001272264631043257A weight value for a given contact, by default is 1ATOMS728=145,594the atoms involved in each of the contacts you wish to calculateSWITCH728={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5665209889411926}The switching functions to use for each of the contacts in your mapWEIGHT728=0.001272264631043257A weight value for a given contact, by default is 1ATOMS729=145,595the atoms involved in each of the contacts you wish to calculateSWITCH729={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.520941436290741}The switching functions to use for each of the contacts in your mapWEIGHT729=0.001272264631043257A weight value for a given contact, by default is 1ATOMS730=145,630the atoms involved in each of the contacts you wish to calculateSWITCH730={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5681661367416382}The switching functions to use for each of the contacts in your mapWEIGHT730=0.001272264631043257A weight value for a given contact, by default is 1ATOMS731=148,580the atoms involved in each of the contacts you wish to calculateSWITCH731={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5768718123435974}The switching functions to use for each of the contacts in your mapWEIGHT731=0.001272264631043257A weight value for a given contact, by default is 1ATOMS732=148,581the atoms involved in each of the contacts you wish to calculateSWITCH732={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5350991487503052}The switching functions to use for each of the contacts in your mapWEIGHT732=0.001272264631043257A weight value for a given contact, by default is 1ATOMS733=148,582the atoms involved in each of the contacts you wish to calculateSWITCH733={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5240075588226318}The switching functions to use for each of the contacts in your mapWEIGHT733=0.001272264631043257A weight value for a given contact, by default is 1ATOMS734=148,584the atoms involved in each of the contacts you wish to calculateSWITCH734={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3957940936088562}The switching functions to use for each of the contacts in your mapWEIGHT734=0.001272264631043257A weight value for a given contact, by default is 1ATOMS735=148,586the atoms involved in each of the contacts you wish to calculateSWITCH735={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4171845316886902}The switching functions to use for each of the contacts in your mapWEIGHT735=0.001272264631043257A weight value for a given contact, by default is 1ATOMS736=148,588the atoms involved in each of the contacts you wish to calculateSWITCH736={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.47629809379577637}The switching functions to use for each of the contacts in your mapWEIGHT736=0.001272264631043257A weight value for a given contact, by default is 1ATOMS737=148,590the atoms involved in each of the contacts you wish to calculateSWITCH737={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.31982025504112244}The switching functions to use for each of the contacts in your mapWEIGHT737=0.001272264631043257A weight value for a given contact, by default is 1ATOMS738=148,594the atoms involved in each of the contacts you wish to calculateSWITCH738={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4200356900691986}The switching functions to use for each of the contacts in your mapWEIGHT738=0.001272264631043257A weight value for a given contact, by default is 1ATOMS739=148,595the atoms involved in each of the contacts you wish to calculateSWITCH739={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3578909933567047}The switching functions to use for each of the contacts in your mapWEIGHT739=0.001272264631043257A weight value for a given contact, by default is 1ATOMS740=148,596the atoms involved in each of the contacts you wish to calculateSWITCH740={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5506514310836792}The switching functions to use for each of the contacts in your mapWEIGHT740=0.001272264631043257A weight value for a given contact, by default is 1ATOMS741=148,626the atoms involved in each of the contacts you wish to calculateSWITCH741={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5499582290649414}The switching functions to use for each of the contacts in your mapWEIGHT741=0.001272264631043257A weight value for a given contact, by default is 1ATOMS742=148,628the atoms involved in each of the contacts you wish to calculateSWITCH742={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49906522035598755}The switching functions to use for each of the contacts in your mapWEIGHT742=0.001272264631043257A weight value for a given contact, by default is 1ATOMS743=148,630the atoms involved in each of the contacts you wish to calculateSWITCH743={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.400346040725708}The switching functions to use for each of the contacts in your mapWEIGHT743=0.001272264631043257A weight value for a given contact, by default is 1ATOMS744=148,633the atoms involved in each of the contacts you wish to calculateSWITCH744={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5002557635307312}The switching functions to use for each of the contacts in your mapWEIGHT744=0.001272264631043257A weight value for a given contact, by default is 1ATOMS745=148,646the atoms involved in each of the contacts you wish to calculateSWITCH745={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4797811508178711}The switching functions to use for each of the contacts in your mapWEIGHT745=0.001272264631043257A weight value for a given contact, by default is 1ATOMS746=148,647the atoms involved in each of the contacts you wish to calculateSWITCH746={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5423163771629333}The switching functions to use for each of the contacts in your mapWEIGHT746=0.001272264631043257A weight value for a given contact, by default is 1ATOMS747=148,648the atoms involved in each of the contacts you wish to calculateSWITCH747={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.43947696685791016}The switching functions to use for each of the contacts in your mapWEIGHT747=0.001272264631043257A weight value for a given contact, by default is 1ATOMS748=148,650the atoms involved in each of the contacts you wish to calculateSWITCH748={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48157763481140137}The switching functions to use for each of the contacts in your mapWEIGHT748=0.001272264631043257A weight value for a given contact, by default is 1ATOMS749=148,652the atoms involved in each of the contacts you wish to calculateSWITCH749={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.488968163728714}The switching functions to use for each of the contacts in your mapWEIGHT749=0.001272264631043257A weight value for a given contact, by default is 1ATOMS750=148,655the atoms involved in each of the contacts you wish to calculateSWITCH750={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5896455645561218}The switching functions to use for each of the contacts in your mapWEIGHT750=0.001272264631043257A weight value for a given contact, by default is 1ATOMS751=148,656the atoms involved in each of the contacts you wish to calculateSWITCH751={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5817885994911194}The switching functions to use for each of the contacts in your mapWEIGHT751=0.001272264631043257A weight value for a given contact, by default is 1ATOMS752=148,701the atoms involved in each of the contacts you wish to calculateSWITCH752={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5995648503303528}The switching functions to use for each of the contacts in your mapWEIGHT752=0.001272264631043257A weight value for a given contact, by default is 1ATOMS753=148,2698the atoms involved in each of the contacts you wish to calculateSWITCH753={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5728715658187866}The switching functions to use for each of the contacts in your mapWEIGHT753=0.001272264631043257A weight value for a given contact, by default is 1ATOMS754=148,2704the atoms involved in each of the contacts you wish to calculateSWITCH754={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5727450847625732}The switching functions to use for each of the contacts in your mapWEIGHT754=0.001272264631043257A weight value for a given contact, by default is 1ATOMS755=149,584the atoms involved in each of the contacts you wish to calculateSWITCH755={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5101195573806763}The switching functions to use for each of the contacts in your mapWEIGHT755=0.001272264631043257A weight value for a given contact, by default is 1ATOMS756=149,586the atoms involved in each of the contacts you wish to calculateSWITCH756={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5241010785102844}The switching functions to use for each of the contacts in your mapWEIGHT756=0.001272264631043257A weight value for a given contact, by default is 1ATOMS757=149,590the atoms involved in each of the contacts you wish to calculateSWITCH757={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4023629426956177}The switching functions to use for each of the contacts in your mapWEIGHT757=0.001272264631043257A weight value for a given contact, by default is 1ATOMS758=149,594the atoms involved in each of the contacts you wish to calculateSWITCH758={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4838542342185974}The switching functions to use for each of the contacts in your mapWEIGHT758=0.001272264631043257A weight value for a given contact, by default is 1ATOMS759=149,595the atoms involved in each of the contacts you wish to calculateSWITCH759={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.38894855976104736}The switching functions to use for each of the contacts in your mapWEIGHT759=0.001272264631043257A weight value for a given contact, by default is 1ATOMS760=149,596the atoms involved in each of the contacts you wish to calculateSWITCH760={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5996214747428894}The switching functions to use for each of the contacts in your mapWEIGHT760=0.001272264631043257A weight value for a given contact, by default is 1ATOMS761=149,626the atoms involved in each of the contacts you wish to calculateSWITCH761={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5773777961730957}The switching functions to use for each of the contacts in your mapWEIGHT761=0.001272264631043257A weight value for a given contact, by default is 1ATOMS762=149,628the atoms involved in each of the contacts you wish to calculateSWITCH762={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5109942555427551}The switching functions to use for each of the contacts in your mapWEIGHT762=0.001272264631043257A weight value for a given contact, by default is 1ATOMS763=149,630the atoms involved in each of the contacts you wish to calculateSWITCH763={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4506794512271881}The switching functions to use for each of the contacts in your mapWEIGHT763=0.001272264631043257A weight value for a given contact, by default is 1ATOMS764=149,633the atoms involved in each of the contacts you wish to calculateSWITCH764={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5796971917152405}The switching functions to use for each of the contacts in your mapWEIGHT764=0.001272264631043257A weight value for a given contact, by default is 1ATOMS765=149,646the atoms involved in each of the contacts you wish to calculateSWITCH765={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4391547739505768}The switching functions to use for each of the contacts in your mapWEIGHT765=0.001272264631043257A weight value for a given contact, by default is 1ATOMS766=149,647the atoms involved in each of the contacts you wish to calculateSWITCH766={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4746769070625305}The switching functions to use for each of the contacts in your mapWEIGHT766=0.001272264631043257A weight value for a given contact, by default is 1ATOMS767=149,648the atoms involved in each of the contacts you wish to calculateSWITCH767={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.38327667117118835}The switching functions to use for each of the contacts in your mapWEIGHT767=0.001272264631043257A weight value for a given contact, by default is 1ATOMS768=149,650the atoms involved in each of the contacts you wish to calculateSWITCH768={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3722928464412689}The switching functions to use for each of the contacts in your mapWEIGHT768=0.001272264631043257A weight value for a given contact, by default is 1ATOMS769=149,652the atoms involved in each of the contacts you wish to calculateSWITCH769={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3782920241355896}The switching functions to use for each of the contacts in your mapWEIGHT769=0.001272264631043257A weight value for a given contact, by default is 1ATOMS770=149,655the atoms involved in each of the contacts you wish to calculateSWITCH770={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4481750726699829}The switching functions to use for each of the contacts in your mapWEIGHT770=0.001272264631043257A weight value for a given contact, by default is 1ATOMS771=149,656the atoms involved in each of the contacts you wish to calculateSWITCH771={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.41668808460235596}The switching functions to use for each of the contacts in your mapWEIGHT771=0.001272264631043257A weight value for a given contact, by default is 1ATOMS772=149,658the atoms involved in each of the contacts you wish to calculateSWITCH772={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5352613925933838}The switching functions to use for each of the contacts in your mapWEIGHT772=0.001272264631043257A weight value for a given contact, by default is 1ATOMS773=149,663the atoms involved in each of the contacts you wish to calculateSWITCH773={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.583707869052887}The switching functions to use for each of the contacts in your mapWEIGHT773=0.001272264631043257A weight value for a given contact, by default is 1ATOMS774=149,667the atoms involved in each of the contacts you wish to calculateSWITCH774={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5153125524520874}The switching functions to use for each of the contacts in your mapWEIGHT774=0.001272264631043257A weight value for a given contact, by default is 1ATOMS775=149,668the atoms involved in each of the contacts you wish to calculateSWITCH775={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5617125630378723}The switching functions to use for each of the contacts in your mapWEIGHT775=0.001272264631043257A weight value for a given contact, by default is 1ATOMS776=149,699the atoms involved in each of the contacts you wish to calculateSWITCH776={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5699878334999084}The switching functions to use for each of the contacts in your mapWEIGHT776=0.001272264631043257A weight value for a given contact, by default is 1ATOMS777=149,701the atoms involved in each of the contacts you wish to calculateSWITCH777={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48607099056243896}The switching functions to use for each of the contacts in your mapWEIGHT777=0.001272264631043257A weight value for a given contact, by default is 1ATOMS778=149,2692the atoms involved in each of the contacts you wish to calculateSWITCH778={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5220784544944763}The switching functions to use for each of the contacts in your mapWEIGHT778=0.001272264631043257A weight value for a given contact, by default is 1ATOMS779=149,2695the atoms involved in each of the contacts you wish to calculateSWITCH779={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5918681025505066}The switching functions to use for each of the contacts in your mapWEIGHT779=0.001272264631043257A weight value for a given contact, by default is 1ATOMS780=149,2698the atoms involved in each of the contacts you wish to calculateSWITCH780={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5204582214355469}The switching functions to use for each of the contacts in your mapWEIGHT780=0.001272264631043257A weight value for a given contact, by default is 1ATOMS781=149,2704the atoms involved in each of the contacts you wish to calculateSWITCH781={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5899304151535034}The switching functions to use for each of the contacts in your mapWEIGHT781=0.001272264631043257A weight value for a given contact, by default is 1ATOMS782=154,526the atoms involved in each of the contacts you wish to calculateSWITCH782={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5903313755989075}The switching functions to use for each of the contacts in your mapWEIGHT782=0.001272264631043257A weight value for a given contact, by default is 1ATOMS783=154,577the atoms involved in each of the contacts you wish to calculateSWITCH783={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49059754610061646}The switching functions to use for each of the contacts in your mapWEIGHT783=0.001272264631043257A weight value for a given contact, by default is 1ATOMS784=154,588the atoms involved in each of the contacts you wish to calculateSWITCH784={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5942767262458801}The switching functions to use for each of the contacts in your mapWEIGHT784=0.001272264631043257A weight value for a given contact, by default is 1ATOMS785=154,630the atoms involved in each of the contacts you wish to calculateSWITCH785={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5996265411376953}The switching functions to use for each of the contacts in your mapWEIGHT785=0.001272264631043257A weight value for a given contact, by default is 1ATOMS786=154,633the atoms involved in each of the contacts you wish to calculateSWITCH786={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.572318971157074}The switching functions to use for each of the contacts in your mapWEIGHT786=0.001272264631043257A weight value for a given contact, by default is 1LABEL=qa label for the action so that its output can be referenced in the input to other actionsSUMcalculate the sum of all the contacts in the inputNOPBC... CONTACTMAPignore the periodic boundary conditions when calculating distancesCONTACTMAP...Calculate the distances between a number of pairs of atoms and transform each distance by a switching function. More detailsATOMS1=73,584the atoms involved in each of the contacts you wish to calculateSWITCH1={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=1.0207823514938354}The switching functions to use for each of the contacts in your mapWEIGHT1=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS2=73,586the atoms involved in each of the contacts you wish to calculateSWITCH2={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9759389162063599}The switching functions to use for each of the contacts in your mapWEIGHT2=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS3=73,588the atoms involved in each of the contacts you wish to calculateSWITCH3={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9939767122268677}The switching functions to use for each of the contacts in your mapWEIGHT3=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS4=73,590the atoms involved in each of the contacts you wish to calculateSWITCH4={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8353566527366638}The switching functions to use for each of the contacts in your mapWEIGHT4=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS5=73,650the atoms involved in each of the contacts you wish to calculateSWITCH5={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9385504126548767}The switching functions to use for each of the contacts in your mapWEIGHT5=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS6=73,652the atoms involved in each of the contacts you wish to calculateSWITCH6={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9241644144058228}The switching functions to use for each of the contacts in your mapWEIGHT6=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS7=73,655the atoms involved in each of the contacts you wish to calculateSWITCH7={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9175434708595276}The switching functions to use for each of the contacts in your mapWEIGHT7=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS8=73,656the atoms involved in each of the contacts you wish to calculateSWITCH8={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8096937537193298}The switching functions to use for each of the contacts in your mapWEIGHT8=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS9=73,658the atoms involved in each of the contacts you wish to calculateSWITCH9={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8399285078048706}The switching functions to use for each of the contacts in your mapWEIGHT9=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS10=73,660the atoms involved in each of the contacts you wish to calculateSWITCH10={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9707099795341492}The switching functions to use for each of the contacts in your mapWEIGHT10=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS11=73,661the atoms involved in each of the contacts you wish to calculateSWITCH11={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=1.0249698162078857}The switching functions to use for each of the contacts in your mapWEIGHT11=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS12=73,663the atoms involved in each of the contacts you wish to calculateSWITCH12={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=1.0370583534240723}The switching functions to use for each of the contacts in your mapWEIGHT12=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS13=73,665the atoms involved in each of the contacts you wish to calculateSWITCH13={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=1.0619831085205078}The switching functions to use for each of the contacts in your mapWEIGHT13=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS14=73,2623the atoms involved in each of the contacts you wish to calculateSWITCH14={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5695807337760925}The switching functions to use for each of the contacts in your mapWEIGHT14=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS15=73,2625the atoms involved in each of the contacts you wish to calculateSWITCH15={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5300518870353699}The switching functions to use for each of the contacts in your mapWEIGHT15=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS16=73,2627the atoms involved in each of the contacts you wish to calculateSWITCH16={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4312378168106079}The switching functions to use for each of the contacts in your mapWEIGHT16=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS17=73,2631the atoms involved in each of the contacts you wish to calculateSWITCH17={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6657891273498535}The switching functions to use for each of the contacts in your mapWEIGHT17=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS18=73,2670the atoms involved in each of the contacts you wish to calculateSWITCH18={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6585873365402222}The switching functions to use for each of the contacts in your mapWEIGHT18=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS19=73,2672the atoms involved in each of the contacts you wish to calculateSWITCH19={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5113325119018555}The switching functions to use for each of the contacts in your mapWEIGHT19=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS20=73,2675the atoms involved in each of the contacts you wish to calculateSWITCH20={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5218219757080078}The switching functions to use for each of the contacts in your mapWEIGHT20=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS21=73,2678the atoms involved in each of the contacts you wish to calculateSWITCH21={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6089567542076111}The switching functions to use for each of the contacts in your mapWEIGHT21=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS22=73,2679the atoms involved in each of the contacts you wish to calculateSWITCH22={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6763537526130676}The switching functions to use for each of the contacts in your mapWEIGHT22=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS23=73,2680the atoms involved in each of the contacts you wish to calculateSWITCH23={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6415490508079529}The switching functions to use for each of the contacts in your mapWEIGHT23=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS24=73,2687the atoms involved in each of the contacts you wish to calculateSWITCH24={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7476959824562073}The switching functions to use for each of the contacts in your mapWEIGHT24=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS25=73,2689the atoms involved in each of the contacts you wish to calculateSWITCH25={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7886298894882202}The switching functions to use for each of the contacts in your mapWEIGHT25=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS26=73,2692the atoms involved in each of the contacts you wish to calculateSWITCH26={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8167563676834106}The switching functions to use for each of the contacts in your mapWEIGHT26=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS27=73,2695the atoms involved in each of the contacts you wish to calculateSWITCH27={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8933829665184021}The switching functions to use for each of the contacts in your mapWEIGHT27=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS28=73,2698the atoms involved in each of the contacts you wish to calculateSWITCH28={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9013334512710571}The switching functions to use for each of the contacts in your mapWEIGHT28=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS29=73,2700the atoms involved in each of the contacts you wish to calculateSWITCH29={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9998608827590942}The switching functions to use for each of the contacts in your mapWEIGHT29=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS30=73,2701the atoms involved in each of the contacts you wish to calculateSWITCH30={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=1.0936754941940308}The switching functions to use for each of the contacts in your mapWEIGHT30=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS31=73,2704the atoms involved in each of the contacts you wish to calculateSWITCH31={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=1.0229334831237793}The switching functions to use for each of the contacts in your mapWEIGHT31=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS32=75,584the atoms involved in each of the contacts you wish to calculateSWITCH32={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=1.02008855342865}The switching functions to use for each of the contacts in your mapWEIGHT32=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS33=75,586the atoms involved in each of the contacts you wish to calculateSWITCH33={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.95534747838974}The switching functions to use for each of the contacts in your mapWEIGHT33=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS34=75,588the atoms involved in each of the contacts you wish to calculateSWITCH34={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.973666250705719}The switching functions to use for each of the contacts in your mapWEIGHT34=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS35=75,590the atoms involved in each of the contacts you wish to calculateSWITCH35={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8102474212646484}The switching functions to use for each of the contacts in your mapWEIGHT35=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS36=75,650the atoms involved in each of the contacts you wish to calculateSWITCH36={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9539626836776733}The switching functions to use for each of the contacts in your mapWEIGHT36=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS37=75,652the atoms involved in each of the contacts you wish to calculateSWITCH37={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.914581835269928}The switching functions to use for each of the contacts in your mapWEIGHT37=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS38=75,655the atoms involved in each of the contacts you wish to calculateSWITCH38={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8970362544059753}The switching functions to use for each of the contacts in your mapWEIGHT38=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS39=75,656the atoms involved in each of the contacts you wish to calculateSWITCH39={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7897898554801941}The switching functions to use for each of the contacts in your mapWEIGHT39=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS40=75,658the atoms involved in each of the contacts you wish to calculateSWITCH40={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8095752000808716}The switching functions to use for each of the contacts in your mapWEIGHT40=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS41=75,660the atoms involved in each of the contacts you wish to calculateSWITCH41={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9316920042037964}The switching functions to use for each of the contacts in your mapWEIGHT41=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS42=75,661the atoms involved in each of the contacts you wish to calculateSWITCH42={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9787600040435791}The switching functions to use for each of the contacts in your mapWEIGHT42=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS43=75,663the atoms involved in each of the contacts you wish to calculateSWITCH43={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=1.0071018934249878}The switching functions to use for each of the contacts in your mapWEIGHT43=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS44=75,665the atoms involved in each of the contacts you wish to calculateSWITCH44={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=1.0238184928894043}The switching functions to use for each of the contacts in your mapWEIGHT44=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS45=75,2623the atoms involved in each of the contacts you wish to calculateSWITCH45={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5463424921035767}The switching functions to use for each of the contacts in your mapWEIGHT45=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS46=75,2625the atoms involved in each of the contacts you wish to calculateSWITCH46={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5381700396537781}The switching functions to use for each of the contacts in your mapWEIGHT46=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS47=75,2627the atoms involved in each of the contacts you wish to calculateSWITCH47={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4755480885505676}The switching functions to use for each of the contacts in your mapWEIGHT47=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS48=75,2631the atoms involved in each of the contacts you wish to calculateSWITCH48={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6863723993301392}The switching functions to use for each of the contacts in your mapWEIGHT48=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS49=75,2670the atoms involved in each of the contacts you wish to calculateSWITCH49={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5225564241409302}The switching functions to use for each of the contacts in your mapWEIGHT49=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS50=75,2672the atoms involved in each of the contacts you wish to calculateSWITCH50={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.37662312388420105}The switching functions to use for each of the contacts in your mapWEIGHT50=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS51=75,2675the atoms involved in each of the contacts you wish to calculateSWITCH51={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4034428596496582}The switching functions to use for each of the contacts in your mapWEIGHT51=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS52=75,2678the atoms involved in each of the contacts you wish to calculateSWITCH52={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.48040005564689636}The switching functions to use for each of the contacts in your mapWEIGHT52=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS53=75,2679the atoms involved in each of the contacts you wish to calculateSWITCH53={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5620198249816895}The switching functions to use for each of the contacts in your mapWEIGHT53=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS54=75,2680the atoms involved in each of the contacts you wish to calculateSWITCH54={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49693572521209717}The switching functions to use for each of the contacts in your mapWEIGHT54=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS55=75,2687the atoms involved in each of the contacts you wish to calculateSWITCH55={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.635346531867981}The switching functions to use for each of the contacts in your mapWEIGHT55=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS56=75,2689the atoms involved in each of the contacts you wish to calculateSWITCH56={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.699663519859314}The switching functions to use for each of the contacts in your mapWEIGHT56=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS57=75,2692the atoms involved in each of the contacts you wish to calculateSWITCH57={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.74198317527771}The switching functions to use for each of the contacts in your mapWEIGHT57=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS58=75,2695the atoms involved in each of the contacts you wish to calculateSWITCH58={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8071710467338562}The switching functions to use for each of the contacts in your mapWEIGHT58=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS59=75,2698the atoms involved in each of the contacts you wish to calculateSWITCH59={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8316332697868347}The switching functions to use for each of the contacts in your mapWEIGHT59=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS60=75,2700the atoms involved in each of the contacts you wish to calculateSWITCH60={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9282057881355286}The switching functions to use for each of the contacts in your mapWEIGHT60=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS61=75,2701the atoms involved in each of the contacts you wish to calculateSWITCH61={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=1.0080684423446655}The switching functions to use for each of the contacts in your mapWEIGHT61=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS62=75,2704the atoms involved in each of the contacts you wish to calculateSWITCH62={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9657996296882629}The switching functions to use for each of the contacts in your mapWEIGHT62=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS63=78,584the atoms involved in each of the contacts you wish to calculateSWITCH63={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.887342095375061}The switching functions to use for each of the contacts in your mapWEIGHT63=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS64=78,586the atoms involved in each of the contacts you wish to calculateSWITCH64={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8156580328941345}The switching functions to use for each of the contacts in your mapWEIGHT64=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS65=78,588the atoms involved in each of the contacts you wish to calculateSWITCH65={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8382583856582642}The switching functions to use for each of the contacts in your mapWEIGHT65=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS66=78,590the atoms involved in each of the contacts you wish to calculateSWITCH66={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6692727208137512}The switching functions to use for each of the contacts in your mapWEIGHT66=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS67=78,650the atoms involved in each of the contacts you wish to calculateSWITCH67={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8519975543022156}The switching functions to use for each of the contacts in your mapWEIGHT67=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS68=78,652the atoms involved in each of the contacts you wish to calculateSWITCH68={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7995429635047913}The switching functions to use for each of the contacts in your mapWEIGHT68=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS69=78,655the atoms involved in each of the contacts you wish to calculateSWITCH69={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7911327481269836}The switching functions to use for each of the contacts in your mapWEIGHT69=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS70=78,656the atoms involved in each of the contacts you wish to calculateSWITCH70={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.696287989616394}The switching functions to use for each of the contacts in your mapWEIGHT70=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS71=78,658the atoms involved in each of the contacts you wish to calculateSWITCH71={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7300910353660583}The switching functions to use for each of the contacts in your mapWEIGHT71=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS72=78,660the atoms involved in each of the contacts you wish to calculateSWITCH72={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8499522805213928}The switching functions to use for each of the contacts in your mapWEIGHT72=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS73=78,661the atoms involved in each of the contacts you wish to calculateSWITCH73={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9108555912971497}The switching functions to use for each of the contacts in your mapWEIGHT73=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS74=78,663the atoms involved in each of the contacts you wish to calculateSWITCH74={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9014616012573242}The switching functions to use for each of the contacts in your mapWEIGHT74=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS75=78,665the atoms involved in each of the contacts you wish to calculateSWITCH75={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9288384914398193}The switching functions to use for each of the contacts in your mapWEIGHT75=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS76=78,2623the atoms involved in each of the contacts you wish to calculateSWITCH76={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5706601738929749}The switching functions to use for each of the contacts in your mapWEIGHT76=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS77=78,2625the atoms involved in each of the contacts you wish to calculateSWITCH77={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5489060878753662}The switching functions to use for each of the contacts in your mapWEIGHT77=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS78=78,2627the atoms involved in each of the contacts you wish to calculateSWITCH78={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5168857574462891}The switching functions to use for each of the contacts in your mapWEIGHT78=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS79=78,2631the atoms involved in each of the contacts you wish to calculateSWITCH79={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6892299652099609}The switching functions to use for each of the contacts in your mapWEIGHT79=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS80=78,2670the atoms involved in each of the contacts you wish to calculateSWITCH80={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5074860453605652}The switching functions to use for each of the contacts in your mapWEIGHT80=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS81=78,2672the atoms involved in each of the contacts you wish to calculateSWITCH81={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3855539858341217}The switching functions to use for each of the contacts in your mapWEIGHT81=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS82=78,2675the atoms involved in each of the contacts you wish to calculateSWITCH82={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4632936120033264}The switching functions to use for each of the contacts in your mapWEIGHT82=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS83=78,2678the atoms involved in each of the contacts you wish to calculateSWITCH83={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5396860837936401}The switching functions to use for each of the contacts in your mapWEIGHT83=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS84=78,2679the atoms involved in each of the contacts you wish to calculateSWITCH84={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6401649117469788}The switching functions to use for each of the contacts in your mapWEIGHT84=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS85=78,2680the atoms involved in each of the contacts you wish to calculateSWITCH85={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5255682468414307}The switching functions to use for each of the contacts in your mapWEIGHT85=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS86=78,2687the atoms involved in each of the contacts you wish to calculateSWITCH86={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5341854691505432}The switching functions to use for each of the contacts in your mapWEIGHT86=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS87=78,2689the atoms involved in each of the contacts you wish to calculateSWITCH87={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5978879332542419}The switching functions to use for each of the contacts in your mapWEIGHT87=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS88=78,2692the atoms involved in each of the contacts you wish to calculateSWITCH88={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6212648153305054}The switching functions to use for each of the contacts in your mapWEIGHT88=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS89=78,2695the atoms involved in each of the contacts you wish to calculateSWITCH89={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6743842959403992}The switching functions to use for each of the contacts in your mapWEIGHT89=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS90=78,2698the atoms involved in each of the contacts you wish to calculateSWITCH90={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6897905468940735}The switching functions to use for each of the contacts in your mapWEIGHT90=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS91=78,2700the atoms involved in each of the contacts you wish to calculateSWITCH91={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7820556163787842}The switching functions to use for each of the contacts in your mapWEIGHT91=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS92=78,2701the atoms involved in each of the contacts you wish to calculateSWITCH92={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8637980818748474}The switching functions to use for each of the contacts in your mapWEIGHT92=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS93=78,2704the atoms involved in each of the contacts you wish to calculateSWITCH93={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.817728579044342}The switching functions to use for each of the contacts in your mapWEIGHT93=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS94=79,584the atoms involved in each of the contacts you wish to calculateSWITCH94={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8389666676521301}The switching functions to use for each of the contacts in your mapWEIGHT94=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS95=79,586the atoms involved in each of the contacts you wish to calculateSWITCH95={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7739489674568176}The switching functions to use for each of the contacts in your mapWEIGHT95=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS96=79,588the atoms involved in each of the contacts you wish to calculateSWITCH96={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8190715312957764}The switching functions to use for each of the contacts in your mapWEIGHT96=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS97=79,590the atoms involved in each of the contacts you wish to calculateSWITCH97={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6218255162239075}The switching functions to use for each of the contacts in your mapWEIGHT97=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS98=79,650the atoms involved in each of the contacts you wish to calculateSWITCH98={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7399952411651611}The switching functions to use for each of the contacts in your mapWEIGHT98=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS99=79,652the atoms involved in each of the contacts you wish to calculateSWITCH99={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6816113591194153}The switching functions to use for each of the contacts in your mapWEIGHT99=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS100=79,655the atoms involved in each of the contacts you wish to calculateSWITCH100={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.661369800567627}The switching functions to use for each of the contacts in your mapWEIGHT100=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS101=79,656the atoms involved in each of the contacts you wish to calculateSWITCH101={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5627663731575012}The switching functions to use for each of the contacts in your mapWEIGHT101=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS102=79,658the atoms involved in each of the contacts you wish to calculateSWITCH102={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5932503342628479}The switching functions to use for each of the contacts in your mapWEIGHT102=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS103=79,660the atoms involved in each of the contacts you wish to calculateSWITCH103={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7126639485359192}The switching functions to use for each of the contacts in your mapWEIGHT103=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS104=79,661the atoms involved in each of the contacts you wish to calculateSWITCH104={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7758923172950745}The switching functions to use for each of the contacts in your mapWEIGHT104=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS105=79,663the atoms involved in each of the contacts you wish to calculateSWITCH105={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7687418460845947}The switching functions to use for each of the contacts in your mapWEIGHT105=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS106=79,665the atoms involved in each of the contacts you wish to calculateSWITCH106={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.792364776134491}The switching functions to use for each of the contacts in your mapWEIGHT106=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS107=79,2623the atoms involved in each of the contacts you wish to calculateSWITCH107={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4883851408958435}The switching functions to use for each of the contacts in your mapWEIGHT107=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS108=79,2625the atoms involved in each of the contacts you wish to calculateSWITCH108={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4583721160888672}The switching functions to use for each of the contacts in your mapWEIGHT108=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS109=79,2627the atoms involved in each of the contacts you wish to calculateSWITCH109={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.45889216661453247}The switching functions to use for each of the contacts in your mapWEIGHT109=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS110=79,2631the atoms involved in each of the contacts you wish to calculateSWITCH110={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5897974371910095}The switching functions to use for each of the contacts in your mapWEIGHT110=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS111=79,2670the atoms involved in each of the contacts you wish to calculateSWITCH111={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.47073233127593994}The switching functions to use for each of the contacts in your mapWEIGHT111=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS112=79,2672the atoms involved in each of the contacts you wish to calculateSWITCH112={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.37130147218704224}The switching functions to use for each of the contacts in your mapWEIGHT112=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS113=79,2675the atoms involved in each of the contacts you wish to calculateSWITCH113={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4750472903251648}The switching functions to use for each of the contacts in your mapWEIGHT113=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS114=79,2678the atoms involved in each of the contacts you wish to calculateSWITCH114={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5751712322235107}The switching functions to use for each of the contacts in your mapWEIGHT114=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS115=79,2679the atoms involved in each of the contacts you wish to calculateSWITCH115={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.683960497379303}The switching functions to use for each of the contacts in your mapWEIGHT115=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS116=79,2680the atoms involved in each of the contacts you wish to calculateSWITCH116={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5653483867645264}The switching functions to use for each of the contacts in your mapWEIGHT116=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS117=79,2687the atoms involved in each of the contacts you wish to calculateSWITCH117={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4333093464374542}The switching functions to use for each of the contacts in your mapWEIGHT117=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS118=79,2689the atoms involved in each of the contacts you wish to calculateSWITCH118={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4748903810977936}The switching functions to use for each of the contacts in your mapWEIGHT118=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS119=79,2692the atoms involved in each of the contacts you wish to calculateSWITCH119={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.498318076133728}The switching functions to use for each of the contacts in your mapWEIGHT119=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS120=79,2695the atoms involved in each of the contacts you wish to calculateSWITCH120={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5692757964134216}The switching functions to use for each of the contacts in your mapWEIGHT120=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS121=79,2698the atoms involved in each of the contacts you wish to calculateSWITCH121={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5925655364990234}The switching functions to use for each of the contacts in your mapWEIGHT121=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS122=79,2700the atoms involved in each of the contacts you wish to calculateSWITCH122={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6987974643707275}The switching functions to use for each of the contacts in your mapWEIGHT122=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS123=79,2701the atoms involved in each of the contacts you wish to calculateSWITCH123={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7840828895568848}The switching functions to use for each of the contacts in your mapWEIGHT123=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS124=79,2704the atoms involved in each of the contacts you wish to calculateSWITCH124={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7450992465019226}The switching functions to use for each of the contacts in your mapWEIGHT124=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS125=81,584the atoms involved in each of the contacts you wish to calculateSWITCH125={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7276957631111145}The switching functions to use for each of the contacts in your mapWEIGHT125=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS126=81,586the atoms involved in each of the contacts you wish to calculateSWITCH126={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6554702520370483}The switching functions to use for each of the contacts in your mapWEIGHT126=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS127=81,588the atoms involved in each of the contacts you wish to calculateSWITCH127={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7096381783485413}The switching functions to use for each of the contacts in your mapWEIGHT127=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS128=81,590the atoms involved in each of the contacts you wish to calculateSWITCH128={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5030259490013123}The switching functions to use for each of the contacts in your mapWEIGHT128=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS129=81,650the atoms involved in each of the contacts you wish to calculateSWITCH129={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.660815417766571}The switching functions to use for each of the contacts in your mapWEIGHT129=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS130=81,652the atoms involved in each of the contacts you wish to calculateSWITCH130={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5840497612953186}The switching functions to use for each of the contacts in your mapWEIGHT130=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS131=81,655the atoms involved in each of the contacts you wish to calculateSWITCH131={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5749348402023315}The switching functions to use for each of the contacts in your mapWEIGHT131=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS132=81,656the atoms involved in each of the contacts you wish to calculateSWITCH132={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49666285514831543}The switching functions to use for each of the contacts in your mapWEIGHT132=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS133=81,658the atoms involved in each of the contacts you wish to calculateSWITCH133={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5448539853096008}The switching functions to use for each of the contacts in your mapWEIGHT133=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS134=81,660the atoms involved in each of the contacts you wish to calculateSWITCH134={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6564555168151855}The switching functions to use for each of the contacts in your mapWEIGHT134=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS135=81,661the atoms involved in each of the contacts you wish to calculateSWITCH135={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7353154420852661}The switching functions to use for each of the contacts in your mapWEIGHT135=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS136=81,663the atoms involved in each of the contacts you wish to calculateSWITCH136={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.680155873298645}The switching functions to use for each of the contacts in your mapWEIGHT136=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS137=81,665the atoms involved in each of the contacts you wish to calculateSWITCH137={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7169783115386963}The switching functions to use for each of the contacts in your mapWEIGHT137=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS138=81,2623the atoms involved in each of the contacts you wish to calculateSWITCH138={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5673164129257202}The switching functions to use for each of the contacts in your mapWEIGHT138=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS139=81,2625the atoms involved in each of the contacts you wish to calculateSWITCH139={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5287578701972961}The switching functions to use for each of the contacts in your mapWEIGHT139=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS140=81,2627the atoms involved in each of the contacts you wish to calculateSWITCH140={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5546619296073914}The switching functions to use for each of the contacts in your mapWEIGHT140=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS141=81,2631the atoms involved in each of the contacts you wish to calculateSWITCH141={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6405161023139954}The switching functions to use for each of the contacts in your mapWEIGHT141=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS142=81,2670the atoms involved in each of the contacts you wish to calculateSWITCH142={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5140514373779297}The switching functions to use for each of the contacts in your mapWEIGHT142=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS143=81,2672the atoms involved in each of the contacts you wish to calculateSWITCH143={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4491288661956787}The switching functions to use for each of the contacts in your mapWEIGHT143=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS144=81,2675the atoms involved in each of the contacts you wish to calculateSWITCH144={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.575529158115387}The switching functions to use for each of the contacts in your mapWEIGHT144=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS145=81,2678the atoms involved in each of the contacts you wish to calculateSWITCH145={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6663916707038879}The switching functions to use for each of the contacts in your mapWEIGHT145=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS146=81,2679the atoms involved in each of the contacts you wish to calculateSWITCH146={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7822620272636414}The switching functions to use for each of the contacts in your mapWEIGHT146=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS147=81,2680the atoms involved in each of the contacts you wish to calculateSWITCH147={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6355177164077759}The switching functions to use for each of the contacts in your mapWEIGHT147=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS148=81,2687the atoms involved in each of the contacts you wish to calculateSWITCH148={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3681969940662384}The switching functions to use for each of the contacts in your mapWEIGHT148=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS149=81,2689the atoms involved in each of the contacts you wish to calculateSWITCH149={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.40097489953041077}The switching functions to use for each of the contacts in your mapWEIGHT149=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS150=81,2692the atoms involved in each of the contacts you wish to calculateSWITCH150={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.39221546053886414}The switching functions to use for each of the contacts in your mapWEIGHT150=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS151=81,2695the atoms involved in each of the contacts you wish to calculateSWITCH151={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44683220982551575}The switching functions to use for each of the contacts in your mapWEIGHT151=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS152=81,2698the atoms involved in each of the contacts you wish to calculateSWITCH152={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.45773574709892273}The switching functions to use for each of the contacts in your mapWEIGHT152=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS153=81,2700the atoms involved in each of the contacts you wish to calculateSWITCH153={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5613145232200623}The switching functions to use for each of the contacts in your mapWEIGHT153=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS154=81,2701the atoms involved in each of the contacts you wish to calculateSWITCH154={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6499893069267273}The switching functions to use for each of the contacts in your mapWEIGHT154=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS155=81,2704the atoms involved in each of the contacts you wish to calculateSWITCH155={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6076850295066833}The switching functions to use for each of the contacts in your mapWEIGHT155=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS156=83,584the atoms involved in each of the contacts you wish to calculateSWITCH156={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6626378893852234}The switching functions to use for each of the contacts in your mapWEIGHT156=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS157=83,586the atoms involved in each of the contacts you wish to calculateSWITCH157={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5716477036476135}The switching functions to use for each of the contacts in your mapWEIGHT157=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS158=83,588the atoms involved in each of the contacts you wish to calculateSWITCH158={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6066747307777405}The switching functions to use for each of the contacts in your mapWEIGHT158=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS159=83,590the atoms involved in each of the contacts you wish to calculateSWITCH159={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.42518115043640137}The switching functions to use for each of the contacts in your mapWEIGHT159=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS160=83,650the atoms involved in each of the contacts you wish to calculateSWITCH160={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7106509804725647}The switching functions to use for each of the contacts in your mapWEIGHT160=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS161=83,652the atoms involved in each of the contacts you wish to calculateSWITCH161={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6270582675933838}The switching functions to use for each of the contacts in your mapWEIGHT161=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS162=83,655the atoms involved in each of the contacts you wish to calculateSWITCH162={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6427394151687622}The switching functions to use for each of the contacts in your mapWEIGHT162=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS163=83,656the atoms involved in each of the contacts you wish to calculateSWITCH163={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5878111720085144}The switching functions to use for each of the contacts in your mapWEIGHT163=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS164=83,658the atoms involved in each of the contacts you wish to calculateSWITCH164={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6509146094322205}The switching functions to use for each of the contacts in your mapWEIGHT164=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS165=83,660the atoms involved in each of the contacts you wish to calculateSWITCH165={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7546826004981995}The switching functions to use for each of the contacts in your mapWEIGHT165=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS166=83,661the atoms involved in each of the contacts you wish to calculateSWITCH166={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8414896726608276}The switching functions to use for each of the contacts in your mapWEIGHT166=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS167=83,663the atoms involved in each of the contacts you wish to calculateSWITCH167={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7463859915733337}The switching functions to use for each of the contacts in your mapWEIGHT167=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS168=83,665the atoms involved in each of the contacts you wish to calculateSWITCH168={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7977380156517029}The switching functions to use for each of the contacts in your mapWEIGHT168=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS169=83,2623the atoms involved in each of the contacts you wish to calculateSWITCH169={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7016836404800415}The switching functions to use for each of the contacts in your mapWEIGHT169=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS170=83,2625the atoms involved in each of the contacts you wish to calculateSWITCH170={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6636209487915039}The switching functions to use for each of the contacts in your mapWEIGHT170=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS171=83,2627the atoms involved in each of the contacts you wish to calculateSWITCH171={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6791272163391113}The switching functions to use for each of the contacts in your mapWEIGHT171=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS172=83,2631the atoms involved in each of the contacts you wish to calculateSWITCH172={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7747547030448914}The switching functions to use for each of the contacts in your mapWEIGHT172=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS173=83,2670the atoms involved in each of the contacts you wish to calculateSWITCH173={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5852016806602478}The switching functions to use for each of the contacts in your mapWEIGHT173=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS174=83,2672the atoms involved in each of the contacts you wish to calculateSWITCH174={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5251750349998474}The switching functions to use for each of the contacts in your mapWEIGHT174=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS175=83,2675the atoms involved in each of the contacts you wish to calculateSWITCH175={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6519492864608765}The switching functions to use for each of the contacts in your mapWEIGHT175=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS176=83,2678the atoms involved in each of the contacts you wish to calculateSWITCH176={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7188921570777893}The switching functions to use for each of the contacts in your mapWEIGHT176=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS177=83,2679the atoms involved in each of the contacts you wish to calculateSWITCH177={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8348329067230225}The switching functions to use for each of the contacts in your mapWEIGHT177=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS178=83,2680the atoms involved in each of the contacts you wish to calculateSWITCH178={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6661552786827087}The switching functions to use for each of the contacts in your mapWEIGHT178=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS179=83,2687the atoms involved in each of the contacts you wish to calculateSWITCH179={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.42556920647621155}The switching functions to use for each of the contacts in your mapWEIGHT179=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS180=83,2689the atoms involved in each of the contacts you wish to calculateSWITCH180={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.477904736995697}The switching functions to use for each of the contacts in your mapWEIGHT180=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS181=83,2692the atoms involved in each of the contacts you wish to calculateSWITCH181={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.44439736008644104}The switching functions to use for each of the contacts in your mapWEIGHT181=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS182=83,2695the atoms involved in each of the contacts you wish to calculateSWITCH182={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4543248414993286}The switching functions to use for each of the contacts in your mapWEIGHT182=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS183=83,2698the atoms involved in each of the contacts you wish to calculateSWITCH183={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4393700361251831}The switching functions to use for each of the contacts in your mapWEIGHT183=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS184=83,2700the atoms involved in each of the contacts you wish to calculateSWITCH184={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.515354335308075}The switching functions to use for each of the contacts in your mapWEIGHT184=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS185=83,2701the atoms involved in each of the contacts you wish to calculateSWITCH185={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6016994118690491}The switching functions to use for each of the contacts in your mapWEIGHT185=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS186=83,2704the atoms involved in each of the contacts you wish to calculateSWITCH186={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5452898740768433}The switching functions to use for each of the contacts in your mapWEIGHT186=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS187=84,584the atoms involved in each of the contacts you wish to calculateSWITCH187={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5641710758209229}The switching functions to use for each of the contacts in your mapWEIGHT187=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS188=84,586the atoms involved in each of the contacts you wish to calculateSWITCH188={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4594290852546692}The switching functions to use for each of the contacts in your mapWEIGHT188=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS189=84,588the atoms involved in each of the contacts you wish to calculateSWITCH189={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5039883255958557}The switching functions to use for each of the contacts in your mapWEIGHT189=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS190=84,590the atoms involved in each of the contacts you wish to calculateSWITCH190={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3194636404514313}The switching functions to use for each of the contacts in your mapWEIGHT190=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS191=84,650the atoms involved in each of the contacts you wish to calculateSWITCH191={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6716910600662231}The switching functions to use for each of the contacts in your mapWEIGHT191=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS192=84,652the atoms involved in each of the contacts you wish to calculateSWITCH192={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5713930726051331}The switching functions to use for each of the contacts in your mapWEIGHT192=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS193=84,655the atoms involved in each of the contacts you wish to calculateSWITCH193={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6032627820968628}The switching functions to use for each of the contacts in your mapWEIGHT193=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS194=84,656the atoms involved in each of the contacts you wish to calculateSWITCH194={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5781124234199524}The switching functions to use for each of the contacts in your mapWEIGHT194=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS195=84,658the atoms involved in each of the contacts you wish to calculateSWITCH195={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6543377041816711}The switching functions to use for each of the contacts in your mapWEIGHT195=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS196=84,660the atoms involved in each of the contacts you wish to calculateSWITCH196={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7429090738296509}The switching functions to use for each of the contacts in your mapWEIGHT196=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS197=84,661the atoms involved in each of the contacts you wish to calculateSWITCH197={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8408096432685852}The switching functions to use for each of the contacts in your mapWEIGHT197=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS198=84,663the atoms involved in each of the contacts you wish to calculateSWITCH198={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6972789764404297}The switching functions to use for each of the contacts in your mapWEIGHT198=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS199=84,665the atoms involved in each of the contacts you wish to calculateSWITCH199={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7621508836746216}The switching functions to use for each of the contacts in your mapWEIGHT199=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS200=84,2623the atoms involved in each of the contacts you wish to calculateSWITCH200={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7993284463882446}The switching functions to use for each of the contacts in your mapWEIGHT200=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS201=84,2625the atoms involved in each of the contacts you wish to calculateSWITCH201={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7566298842430115}The switching functions to use for each of the contacts in your mapWEIGHT201=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS202=84,2627the atoms involved in each of the contacts you wish to calculateSWITCH202={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7882143259048462}The switching functions to use for each of the contacts in your mapWEIGHT202=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS203=84,2631the atoms involved in each of the contacts you wish to calculateSWITCH203={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8517116904258728}The switching functions to use for each of the contacts in your mapWEIGHT203=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS204=84,2670the atoms involved in each of the contacts you wish to calculateSWITCH204={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6684152483940125}The switching functions to use for each of the contacts in your mapWEIGHT204=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS205=84,2672the atoms involved in each of the contacts you wish to calculateSWITCH205={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6336818933486938}The switching functions to use for each of the contacts in your mapWEIGHT205=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS206=84,2675the atoms involved in each of the contacts you wish to calculateSWITCH206={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7705087661743164}The switching functions to use for each of the contacts in your mapWEIGHT206=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS207=84,2678the atoms involved in each of the contacts you wish to calculateSWITCH207={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8325706720352173}The switching functions to use for each of the contacts in your mapWEIGHT207=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS208=84,2679the atoms involved in each of the contacts you wish to calculateSWITCH208={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.951357901096344}The switching functions to use for each of the contacts in your mapWEIGHT208=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS209=84,2680the atoms involved in each of the contacts you wish to calculateSWITCH209={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7681983709335327}The switching functions to use for each of the contacts in your mapWEIGHT209=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS210=84,2687the atoms involved in each of the contacts you wish to calculateSWITCH210={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4334825575351715}The switching functions to use for each of the contacts in your mapWEIGHT210=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS211=84,2689the atoms involved in each of the contacts you wish to calculateSWITCH211={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4717487394809723}The switching functions to use for each of the contacts in your mapWEIGHT211=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS212=84,2692the atoms involved in each of the contacts you wish to calculateSWITCH212={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4009949862957001}The switching functions to use for each of the contacts in your mapWEIGHT212=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS213=84,2695the atoms involved in each of the contacts you wish to calculateSWITCH213={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3724633753299713}The switching functions to use for each of the contacts in your mapWEIGHT213=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS214=84,2698the atoms involved in each of the contacts you wish to calculateSWITCH214={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.327600359916687}The switching functions to use for each of the contacts in your mapWEIGHT214=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS215=84,2700the atoms involved in each of the contacts you wish to calculateSWITCH215={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.3835701048374176}The switching functions to use for each of the contacts in your mapWEIGHT215=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS216=84,2701the atoms involved in each of the contacts you wish to calculateSWITCH216={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4734238088130951}The switching functions to use for each of the contacts in your mapWEIGHT216=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS217=84,2704the atoms involved in each of the contacts you wish to calculateSWITCH217={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.40682312846183777}The switching functions to use for each of the contacts in your mapWEIGHT217=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS218=86,584the atoms involved in each of the contacts you wish to calculateSWITCH218={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8340857625007629}The switching functions to use for each of the contacts in your mapWEIGHT218=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS219=86,586the atoms involved in each of the contacts you wish to calculateSWITCH219={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7490453720092773}The switching functions to use for each of the contacts in your mapWEIGHT219=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS220=86,588the atoms involved in each of the contacts you wish to calculateSWITCH220={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7522912621498108}The switching functions to use for each of the contacts in your mapWEIGHT220=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS221=86,590the atoms involved in each of the contacts you wish to calculateSWITCH221={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6119616031646729}The switching functions to use for each of the contacts in your mapWEIGHT221=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS222=86,650the atoms involved in each of the contacts you wish to calculateSWITCH222={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8905701041221619}The switching functions to use for each of the contacts in your mapWEIGHT222=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS223=86,652the atoms involved in each of the contacts you wish to calculateSWITCH223={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8305865526199341}The switching functions to use for each of the contacts in your mapWEIGHT223=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS224=86,655the atoms involved in each of the contacts you wish to calculateSWITCH224={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.840754508972168}The switching functions to use for each of the contacts in your mapWEIGHT224=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS225=86,656the atoms involved in each of the contacts you wish to calculateSWITCH225={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7631474733352661}The switching functions to use for each of the contacts in your mapWEIGHT225=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS226=86,658the atoms involved in each of the contacts you wish to calculateSWITCH226={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8114715218544006}The switching functions to use for each of the contacts in your mapWEIGHT226=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS227=86,660the atoms involved in each of the contacts you wish to calculateSWITCH227={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9269519448280334}The switching functions to use for each of the contacts in your mapWEIGHT227=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS228=86,661the atoms involved in each of the contacts you wish to calculateSWITCH228={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9975895285606384}The switching functions to use for each of the contacts in your mapWEIGHT228=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS229=86,663the atoms involved in each of the contacts you wish to calculateSWITCH229={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9513727426528931}The switching functions to use for each of the contacts in your mapWEIGHT229=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS230=86,665the atoms involved in each of the contacts you wish to calculateSWITCH230={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9914444088935852}The switching functions to use for each of the contacts in your mapWEIGHT230=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS231=86,2623the atoms involved in each of the contacts you wish to calculateSWITCH231={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7043337821960449}The switching functions to use for each of the contacts in your mapWEIGHT231=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS232=86,2625the atoms involved in each of the contacts you wish to calculateSWITCH232={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6798242926597595}The switching functions to use for each of the contacts in your mapWEIGHT232=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS233=86,2627the atoms involved in each of the contacts you wish to calculateSWITCH233={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.649070143699646}The switching functions to use for each of the contacts in your mapWEIGHT233=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS234=86,2631the atoms involved in each of the contacts you wish to calculateSWITCH234={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8154760003089905}The switching functions to use for each of the contacts in your mapWEIGHT234=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS235=86,2670the atoms involved in each of the contacts you wish to calculateSWITCH235={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5786440372467041}The switching functions to use for each of the contacts in your mapWEIGHT235=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS236=86,2672the atoms involved in each of the contacts you wish to calculateSWITCH236={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.4714941680431366}The switching functions to use for each of the contacts in your mapWEIGHT236=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS237=86,2675the atoms involved in each of the contacts you wish to calculateSWITCH237={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5553250312805176}The switching functions to use for each of the contacts in your mapWEIGHT237=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS238=86,2678the atoms involved in each of the contacts you wish to calculateSWITCH238={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.603242814540863}The switching functions to use for each of the contacts in your mapWEIGHT238=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS239=86,2679the atoms involved in each of the contacts you wish to calculateSWITCH239={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7035395503044128}The switching functions to use for each of the contacts in your mapWEIGHT239=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS240=86,2680the atoms involved in each of the contacts you wish to calculateSWITCH240={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.561893880367279}The switching functions to use for each of the contacts in your mapWEIGHT240=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS241=86,2687the atoms involved in each of the contacts you wish to calculateSWITCH241={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5737917423248291}The switching functions to use for each of the contacts in your mapWEIGHT241=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS242=86,2689the atoms involved in each of the contacts you wish to calculateSWITCH242={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6506557464599609}The switching functions to use for each of the contacts in your mapWEIGHT242=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS243=86,2692the atoms involved in each of the contacts you wish to calculateSWITCH243={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6540802121162415}The switching functions to use for each of the contacts in your mapWEIGHT243=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS244=86,2695the atoms involved in each of the contacts you wish to calculateSWITCH244={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.677808940410614}The switching functions to use for each of the contacts in your mapWEIGHT244=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS245=86,2698the atoms involved in each of the contacts you wish to calculateSWITCH245={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6762543320655823}The switching functions to use for each of the contacts in your mapWEIGHT245=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS246=86,2700the atoms involved in each of the contacts you wish to calculateSWITCH246={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7482271194458008}The switching functions to use for each of the contacts in your mapWEIGHT246=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS247=86,2701the atoms involved in each of the contacts you wish to calculateSWITCH247={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8264477252960205}The switching functions to use for each of the contacts in your mapWEIGHT247=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS248=86,2704the atoms involved in each of the contacts you wish to calculateSWITCH248={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7710998058319092}The switching functions to use for each of the contacts in your mapWEIGHT248=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS249=88,584the atoms involved in each of the contacts you wish to calculateSWITCH249={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.722584068775177}The switching functions to use for each of the contacts in your mapWEIGHT249=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS250=88,586the atoms involved in each of the contacts you wish to calculateSWITCH250={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6265859007835388}The switching functions to use for each of the contacts in your mapWEIGHT250=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS251=88,588the atoms involved in each of the contacts you wish to calculateSWITCH251={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6319659352302551}The switching functions to use for each of the contacts in your mapWEIGHT251=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS252=88,590the atoms involved in each of the contacts you wish to calculateSWITCH252={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.49149349331855774}The switching functions to use for each of the contacts in your mapWEIGHT252=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS253=88,650the atoms involved in each of the contacts you wish to calculateSWITCH253={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8263533115386963}The switching functions to use for each of the contacts in your mapWEIGHT253=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS254=88,652the atoms involved in each of the contacts you wish to calculateSWITCH254={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7532628774642944}The switching functions to use for each of the contacts in your mapWEIGHT254=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS255=88,655the atoms involved in each of the contacts you wish to calculateSWITCH255={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7753212451934814}The switching functions to use for each of the contacts in your mapWEIGHT255=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS256=88,656the atoms involved in each of the contacts you wish to calculateSWITCH256={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7163525223731995}The switching functions to use for each of the contacts in your mapWEIGHT256=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS257=88,658the atoms involved in each of the contacts you wish to calculateSWITCH257={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7773705720901489}The switching functions to use for each of the contacts in your mapWEIGHT257=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS258=88,660the atoms involved in each of the contacts you wish to calculateSWITCH258={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8852134943008423}The switching functions to use for each of the contacts in your mapWEIGHT258=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS259=88,661the atoms involved in each of the contacts you wish to calculateSWITCH259={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.9670998454093933}The switching functions to use for each of the contacts in your mapWEIGHT259=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS260=88,663the atoms involved in each of the contacts you wish to calculateSWITCH260={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.882206916809082}The switching functions to use for each of the contacts in your mapWEIGHT260=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS261=88,665the atoms involved in each of the contacts you wish to calculateSWITCH261={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.933173656463623}The switching functions to use for each of the contacts in your mapWEIGHT261=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS262=88,2623the atoms involved in each of the contacts you wish to calculateSWITCH262={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7609344124794006}The switching functions to use for each of the contacts in your mapWEIGHT262=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS263=88,2625the atoms involved in each of the contacts you wish to calculateSWITCH263={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7287756204605103}The switching functions to use for each of the contacts in your mapWEIGHT263=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS264=88,2627the atoms involved in each of the contacts you wish to calculateSWITCH264={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7192571759223938}The switching functions to use for each of the contacts in your mapWEIGHT264=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS265=88,2631the atoms involved in each of the contacts you wish to calculateSWITCH265={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.8526136875152588}The switching functions to use for each of the contacts in your mapWEIGHT265=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS266=88,2670the atoms involved in each of the contacts you wish to calculateSWITCH266={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6147701144218445}The switching functions to use for each of the contacts in your mapWEIGHT266=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS267=88,2672the atoms involved in each of the contacts you wish to calculateSWITCH267={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5349056124687195}The switching functions to use for each of the contacts in your mapWEIGHT267=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS268=88,2675the atoms involved in each of the contacts you wish to calculateSWITCH268={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6430685520172119}The switching functions to use for each of the contacts in your mapWEIGHT268=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS269=88,2678the atoms involved in each of the contacts you wish to calculateSWITCH269={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6904876828193665}The switching functions to use for each of the contacts in your mapWEIGHT269=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS270=88,2679the atoms involved in each of the contacts you wish to calculateSWITCH270={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7990514636039734}The switching functions to use for each of the contacts in your mapWEIGHT270=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS271=88,2680the atoms involved in each of the contacts you wish to calculateSWITCH271={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6323718428611755}The switching functions to use for each of the contacts in your mapWEIGHT271=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS272=88,2687the atoms involved in each of the contacts you wish to calculateSWITCH272={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5274791717529297}The switching functions to use for each of the contacts in your mapWEIGHT272=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS273=88,2689the atoms involved in each of the contacts you wish to calculateSWITCH273={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.599891722202301}The switching functions to use for each of the contacts in your mapWEIGHT273=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS274=88,2692the atoms involved in each of the contacts you wish to calculateSWITCH274={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5785033106803894}The switching functions to use for each of the contacts in your mapWEIGHT274=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS275=88,2695the atoms involved in each of the contacts you wish to calculateSWITCH275={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.580222487449646}The switching functions to use for each of the contacts in your mapWEIGHT275=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS276=88,2698the atoms involved in each of the contacts you wish to calculateSWITCH276={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.5632504224777222}The switching functions to use for each of the contacts in your mapWEIGHT276=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS277=88,2700the atoms involved in each of the contacts you wish to calculateSWITCH277={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6232262849807739}The switching functions to use for each of the contacts in your mapWEIGHT277=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS278=88,2701the atoms involved in each of the contacts you wish to calculateSWITCH278={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.7020905017852783}The switching functions to use for each of the contacts in your mapWEIGHT278=0.0035842293906810036A weight value for a given contact, by default is 1ATOMS279=88,2704the atoms involved in each of the contacts you wish to calculateSWITCH279={Q R_0=0.01 BETA=50.0 LAMBDA=2. REF=0.6406059265136719}The switching functions to use for each of the contacts in your mapWEIGHT279=0.0035842293906810036A weight value for a given contact, by default is 1LABEL=qtyra label for the action so that its output can be referenced in the input to other actionsSUMcalculate the sum of all the contacts in the inputNOPBC... CONTACTMAPignore the periodic boundary conditions when calculating distancesALPHABETA...Measures a distance including pbc between the instantaneous values of a set of torsional angles and set of reference values. More detailsATOMS1=16,18,20,23the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE1=1.8913875818252563the reference values for each of the torsional anglesATOMS2=18,20,23,25the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE2=-0.8886736035346985the reference values for each of the torsional anglesATOMS3=23,25,27,35the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE3=-1.1935278177261353the reference values for each of the torsional anglesATOMS4=25,27,35,37the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE4=-0.6273089647293091the reference values for each of the torsional anglesATOMS5=35,37,39,50the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE5=-1.1674542427062988the reference values for each of the torsional anglesATOMS6=37,39,50,52the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE6=-0.7660514712333679the reference values for each of the torsional anglesATOMS7=50,52,54,69the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE7=-1.048201322555542the reference values for each of the torsional anglesATOMS8=52,54,69,71the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE8=-0.7810516953468323the reference values for each of the torsional anglesATOMS9=69,71,73,90the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE9=-1.1226352453231812the reference values for each of the torsional anglesATOMS10=71,73,90,92the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE10=-0.7955121994018555the reference values for each of the torsional anglesATOMS11=90,92,94,105the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE11=-1.1006927490234375the reference values for each of the torsional anglesATOMS12=92,94,105,107the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE12=-0.6953843832015991the reference values for each of the torsional anglesATOMS13=105,107,109,117the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE13=-1.0538326501846313the reference values for each of the torsional anglesATOMS14=107,109,117,119the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE14=-0.9149022698402405the reference values for each of the torsional anglesATOMS15=117,119,121,136the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE15=-1.1459203958511353the reference values for each of the torsional anglesATOMS16=119,121,136,138the atoms involved in each of the alpha-beta variables you wish to calculateREFERENCE16=-0.7590166926383972the reference values for each of the torsional anglesLABEL=ab ... ALPHABETAa label for the action so that its output can be referenced in the input to other actionsPrint quantities to a file. More detailsARG=q,ab,qtyrthe input for this action is the scalar output from one or more other actionsFILE=CV_cry_c36mthe name of the file on which to output these quantities