PLUMED-NEST

Project ID: plumID:25.023
Source: trimer/bias_2/plumed.dat
Originally used with PLUMED version: 2.8
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

RESTARTActivate restart. More details
The RESTART action with label  calculates somethingrmsda: RMSDCalculate the RMSD with respect to a reference structure. More details REFERENCEa file in pdb format containing the reference structure and the atoms involved in the CV=prot_ref_a.pdb TYPE the manner in which RMSD alignment is performed=OPTIMAL
The RMSD action with label rmsda calculates the following quantities:
 Quantity   
 Description  
rmsda.value
the RMSD distance between the instaneous structure and the reference structure/s that were inputrmsdb: RMSDCalculate the RMSD with respect to a reference structure. More details REFERENCEa file in pdb format containing the reference structure and the atoms involved in the CV=prot_ref_b.pdb TYPE the manner in which RMSD alignment is performed=OPTIMAL
The RMSD action with label rmsdb calculates the following quantities:
 Quantity   
 Description  
rmsdb.value
the RMSD distance between the instaneous structure and the reference structure/s that were inputrmsdc: RMSDCalculate the RMSD with respect to a reference structure. More details REFERENCEa file in pdb format containing the reference structure and the atoms involved in the CV=prot_ref_c.pdb TYPE the manner in which RMSD alignment is performed=OPTIMAL
The RMSD action with label rmsdc calculates the following quantities:
 Quantity   
 Description  
rmsdc.value
the RMSD distance between the instaneous structure and the reference structure/s that were inputsumrmsdint: CUSTOMCalculate a combination of variables using a custom expression. More details ARGthe values input to this function=rmsda,rmsdb,rmsdc VARthe names to give each of the arguments in the function=ax,bx,cx FUNCthe function you wish to evaluate=sqrt(ax*ax+bx*bx+cx*cx) PERIODICif the output of your function is periodic then you should specify the periodicity of the function=NO

The CUSTOM action with label sumrmsdint calculates the following quantities:
 Quantity   
 Description  
sumrmsdint.value
an arbitrary functioncmapab: CONTACTMAPCalculate the distances between a number of pairs of atoms and transform each distance by a switching function. More details ...
   ATOMS1the atoms involved in each of the contacts you wish to calculate=1,1198 SWITCH1The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5929} WEIGHT1A weight value for a given contact, by default is 1=0.00325733
   ATOMS2the atoms involved in each of the contacts you wish to calculate=5,1202 SWITCH2The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5233} WEIGHT2A weight value for a given contact, by default is 1=0.00325733
   ATOMS3the atoms involved in each of the contacts you wish to calculate=8,1205 SWITCH3The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5055} WEIGHT3A weight value for a given contact, by default is 1=0.00325733
   ATOMS4the atoms involved in each of the contacts you wish to calculate=9,1206 SWITCH4The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5060} WEIGHT4A weight value for a given contact, by default is 1=0.00325733
   ATOMS5the atoms involved in each of the contacts you wish to calculate=10,1207 SWITCH5The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4996} WEIGHT5A weight value for a given contact, by default is 1=0.00325733
   ATOMS6the atoms involved in each of the contacts you wish to calculate=12,1209 SWITCH6The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4974} WEIGHT6A weight value for a given contact, by default is 1=0.00325733
   ATOMS7the atoms involved in each of the contacts you wish to calculate=19,1216 SWITCH7The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4918} WEIGHT7A weight value for a given contact, by default is 1=0.00325733
   ATOMS8the atoms involved in each of the contacts you wish to calculate=20,1217 SWITCH8The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4968} WEIGHT8A weight value for a given contact, by default is 1=0.00325733
   ATOMS9the atoms involved in each of the contacts you wish to calculate=21,1218 SWITCH9The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4837} WEIGHT9A weight value for a given contact, by default is 1=0.00325733
   ATOMS10the atoms involved in each of the contacts you wish to calculate=23,1220 SWITCH10The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4806} WEIGHT10A weight value for a given contact, by default is 1=0.00325733
   ATOMS11the atoms involved in each of the contacts you wish to calculate=35,1232 SWITCH11The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4819} WEIGHT11A weight value for a given contact, by default is 1=0.00325733
   ATOMS12the atoms involved in each of the contacts you wish to calculate=36,1233 SWITCH12The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4817} WEIGHT12A weight value for a given contact, by default is 1=0.00325733
   ATOMS13the atoms involved in each of the contacts you wish to calculate=37,1234 SWITCH13The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4826} WEIGHT13A weight value for a given contact, by default is 1=0.00325733
   ATOMS14the atoms involved in each of the contacts you wish to calculate=39,1236 SWITCH14The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4809} WEIGHT14A weight value for a given contact, by default is 1=0.00325733
   ATOMS15the atoms involved in each of the contacts you wish to calculate=52,1249 SWITCH15The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4787} WEIGHT15A weight value for a given contact, by default is 1=0.00325733
   ATOMS16the atoms involved in each of the contacts you wish to calculate=53,1250 SWITCH16The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4780} WEIGHT16A weight value for a given contact, by default is 1=0.00325733
   ATOMS17the atoms involved in each of the contacts you wish to calculate=54,1251 SWITCH17The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4762} WEIGHT17A weight value for a given contact, by default is 1=0.00325733
   ATOMS18the atoms involved in each of the contacts you wish to calculate=56,1253 SWITCH18The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4713} WEIGHT18A weight value for a given contact, by default is 1=0.00325733
   ATOMS19the atoms involved in each of the contacts you wish to calculate=71,1268 SWITCH19The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4777} WEIGHT19A weight value for a given contact, by default is 1=0.00325733
   ATOMS20the atoms involved in each of the contacts you wish to calculate=72,1269 SWITCH20The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4793} WEIGHT20A weight value for a given contact, by default is 1=0.00325733
   ATOMS21the atoms involved in each of the contacts you wish to calculate=73,1270 SWITCH21The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4817} WEIGHT21A weight value for a given contact, by default is 1=0.00325733
   ATOMS22the atoms involved in each of the contacts you wish to calculate=75,1272 SWITCH22The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4837} WEIGHT22A weight value for a given contact, by default is 1=0.00325733
   ATOMS23the atoms involved in each of the contacts you wish to calculate=87,1284 SWITCH23The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4841} WEIGHT23A weight value for a given contact, by default is 1=0.00325733
   ATOMS24the atoms involved in each of the contacts you wish to calculate=88,1285 SWITCH24The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4843} WEIGHT24A weight value for a given contact, by default is 1=0.00325733
   ATOMS25the atoms involved in each of the contacts you wish to calculate=89,1286 SWITCH25The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4832} WEIGHT25A weight value for a given contact, by default is 1=0.00325733
   ATOMS26the atoms involved in each of the contacts you wish to calculate=91,1288 SWITCH26The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4881} WEIGHT26A weight value for a given contact, by default is 1=0.00325733
   ATOMS27the atoms involved in each of the contacts you wish to calculate=108,1305 SWITCH27The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4947} WEIGHT27A weight value for a given contact, by default is 1=0.00325733
   ATOMS28the atoms involved in each of the contacts you wish to calculate=109,1306 SWITCH28The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4973} WEIGHT28A weight value for a given contact, by default is 1=0.00325733
   ATOMS29the atoms involved in each of the contacts you wish to calculate=110,1307 SWITCH29The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4999} WEIGHT29A weight value for a given contact, by default is 1=0.00325733
   ATOMS30the atoms involved in each of the contacts you wish to calculate=112,1309 SWITCH30The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5048} WEIGHT30A weight value for a given contact, by default is 1=0.00325733
   ATOMS31the atoms involved in each of the contacts you wish to calculate=130,1327 SWITCH31The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5114} WEIGHT31A weight value for a given contact, by default is 1=0.00325733
   ATOMS32the atoms involved in each of the contacts you wish to calculate=131,1328 SWITCH32The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5396} WEIGHT32A weight value for a given contact, by default is 1=0.00325733
   ATOMS33the atoms involved in each of the contacts you wish to calculate=132,1329 SWITCH33The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4837} WEIGHT33A weight value for a given contact, by default is 1=0.00325733
   ATOMS34the atoms involved in each of the contacts you wish to calculate=136,1333 SWITCH34The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5034} WEIGHT34A weight value for a given contact, by default is 1=0.00325733
   ATOMS35the atoms involved in each of the contacts you wish to calculate=144,1341 SWITCH35The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4990} WEIGHT35A weight value for a given contact, by default is 1=0.00325733
   ATOMS36the atoms involved in each of the contacts you wish to calculate=145,1342 SWITCH36The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4996} WEIGHT36A weight value for a given contact, by default is 1=0.00325733
   ATOMS37the atoms involved in each of the contacts you wish to calculate=146,1343 SWITCH37The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4986} WEIGHT37A weight value for a given contact, by default is 1=0.00325733
   ATOMS38the atoms involved in each of the contacts you wish to calculate=148,1345 SWITCH38The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4970} WEIGHT38A weight value for a given contact, by default is 1=0.00325733
   ATOMS39the atoms involved in each of the contacts you wish to calculate=160,1357 SWITCH39The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5113} WEIGHT39A weight value for a given contact, by default is 1=0.00325733
   ATOMS40the atoms involved in each of the contacts you wish to calculate=161,1358 SWITCH40The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5523} WEIGHT40A weight value for a given contact, by default is 1=0.00325733
   ATOMS41the atoms involved in each of the contacts you wish to calculate=162,1359 SWITCH41The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4840} WEIGHT41A weight value for a given contact, by default is 1=0.00325733
   ATOMS42the atoms involved in each of the contacts you wish to calculate=164,1361 SWITCH42The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4922} WEIGHT42A weight value for a given contact, by default is 1=0.00325733
   ATOMS43the atoms involved in each of the contacts you wish to calculate=172,1369 SWITCH43The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4940} WEIGHT43A weight value for a given contact, by default is 1=0.00325733
   ATOMS44the atoms involved in each of the contacts you wish to calculate=173,1370 SWITCH44The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4980} WEIGHT44A weight value for a given contact, by default is 1=0.00325733
   ATOMS45the atoms involved in each of the contacts you wish to calculate=174,1371 SWITCH45The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4946} WEIGHT45A weight value for a given contact, by default is 1=0.00325733
   ATOMS46the atoms involved in each of the contacts you wish to calculate=176,1373 SWITCH46The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5018} WEIGHT46A weight value for a given contact, by default is 1=0.00325733
   ATOMS47the atoms involved in each of the contacts you wish to calculate=191,1388 SWITCH47The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4968} WEIGHT47A weight value for a given contact, by default is 1=0.00325733
   ATOMS48the atoms involved in each of the contacts you wish to calculate=192,1389 SWITCH48The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5430} WEIGHT48A weight value for a given contact, by default is 1=0.00325733
   ATOMS49the atoms involved in each of the contacts you wish to calculate=193,1390 SWITCH49The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4400} WEIGHT49A weight value for a given contact, by default is 1=0.00325733
   ATOMS50the atoms involved in each of the contacts you wish to calculate=195,1392 SWITCH50The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4472} WEIGHT50A weight value for a given contact, by default is 1=0.00325733
   ATOMS51the atoms involved in each of the contacts you wish to calculate=202,1399 SWITCH51The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4538} WEIGHT51A weight value for a given contact, by default is 1=0.00325733
   ATOMS52the atoms involved in each of the contacts you wish to calculate=203,1400 SWITCH52The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4172} WEIGHT52A weight value for a given contact, by default is 1=0.00325733
   ATOMS53the atoms involved in each of the contacts you wish to calculate=204,1401 SWITCH53The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5041} WEIGHT53A weight value for a given contact, by default is 1=0.00325733
   ATOMS54the atoms involved in each of the contacts you wish to calculate=206,1403 SWITCH54The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4964} WEIGHT54A weight value for a given contact, by default is 1=0.00325733
   ATOMS55the atoms involved in each of the contacts you wish to calculate=224,1421 SWITCH55The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4768} WEIGHT55A weight value for a given contact, by default is 1=0.00325733
   ATOMS56the atoms involved in each of the contacts you wish to calculate=225,1422 SWITCH56The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4617} WEIGHT56A weight value for a given contact, by default is 1=0.00325733
   ATOMS57the atoms involved in each of the contacts you wish to calculate=226,1423 SWITCH57The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4875} WEIGHT57A weight value for a given contact, by default is 1=0.00325733
   ATOMS58the atoms involved in each of the contacts you wish to calculate=228,1425 SWITCH58The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4770} WEIGHT58A weight value for a given contact, by default is 1=0.00325733
   ATOMS59the atoms involved in each of the contacts you wish to calculate=240,1437 SWITCH59The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4744} WEIGHT59A weight value for a given contact, by default is 1=0.00325733
   ATOMS60the atoms involved in each of the contacts you wish to calculate=241,1438 SWITCH60The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4772} WEIGHT60A weight value for a given contact, by default is 1=0.00325733
   ATOMS61the atoms involved in each of the contacts you wish to calculate=242,1439 SWITCH61The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4715} WEIGHT61A weight value for a given contact, by default is 1=0.00325733
   ATOMS62the atoms involved in each of the contacts you wish to calculate=244,1441 SWITCH62The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4700} WEIGHT62A weight value for a given contact, by default is 1=0.00325733
   ATOMS63the atoms involved in each of the contacts you wish to calculate=254,1451 SWITCH63The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4739} WEIGHT63A weight value for a given contact, by default is 1=0.00325733
   ATOMS64the atoms involved in each of the contacts you wish to calculate=255,1452 SWITCH64The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4732} WEIGHT64A weight value for a given contact, by default is 1=0.00325733
   ATOMS65the atoms involved in each of the contacts you wish to calculate=256,1453 SWITCH65The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4771} WEIGHT65A weight value for a given contact, by default is 1=0.00325733
   ATOMS66the atoms involved in each of the contacts you wish to calculate=258,1455 SWITCH66The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4826} WEIGHT66A weight value for a given contact, by default is 1=0.00325733
   ATOMS67the atoms involved in each of the contacts you wish to calculate=265,1462 SWITCH67The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4930} WEIGHT67A weight value for a given contact, by default is 1=0.00325733
   ATOMS68the atoms involved in each of the contacts you wish to calculate=266,1463 SWITCH68The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4945} WEIGHT68A weight value for a given contact, by default is 1=0.00325733
   ATOMS69the atoms involved in each of the contacts you wish to calculate=267,1464 SWITCH69The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5000} WEIGHT69A weight value for a given contact, by default is 1=0.00325733
   ATOMS70the atoms involved in each of the contacts you wish to calculate=269,1466 SWITCH70The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5141} WEIGHT70A weight value for a given contact, by default is 1=0.00325733
   ATOMS71the atoms involved in each of the contacts you wish to calculate=287,1484 SWITCH71The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4851} WEIGHT71A weight value for a given contact, by default is 1=0.00325733
   ATOMS72the atoms involved in each of the contacts you wish to calculate=288,1485 SWITCH72The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4837} WEIGHT72A weight value for a given contact, by default is 1=0.00325733
   ATOMS73the atoms involved in each of the contacts you wish to calculate=289,1486 SWITCH73The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4672} WEIGHT73A weight value for a given contact, by default is 1=0.00325733
   ATOMS74the atoms involved in each of the contacts you wish to calculate=291,1488 SWITCH74The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4434} WEIGHT74A weight value for a given contact, by default is 1=0.00325733
   ATOMS75the atoms involved in each of the contacts you wish to calculate=298,1495 SWITCH75The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4529} WEIGHT75A weight value for a given contact, by default is 1=0.00325733
   ATOMS76the atoms involved in each of the contacts you wish to calculate=299,1496 SWITCH76The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4567} WEIGHT76A weight value for a given contact, by default is 1=0.00325733
   ATOMS77the atoms involved in each of the contacts you wish to calculate=300,1497 SWITCH77The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4564} WEIGHT77A weight value for a given contact, by default is 1=0.00325733
   ATOMS78the atoms involved in each of the contacts you wish to calculate=302,1499 SWITCH78The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4664} WEIGHT78A weight value for a given contact, by default is 1=0.00325733
   ATOMS79the atoms involved in each of the contacts you wish to calculate=305,1502 SWITCH79The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4592} WEIGHT79A weight value for a given contact, by default is 1=0.00325733
   ATOMS80the atoms involved in each of the contacts you wish to calculate=306,1503 SWITCH80The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4403} WEIGHT80A weight value for a given contact, by default is 1=0.00325733
   ATOMS81the atoms involved in each of the contacts you wish to calculate=307,1504 SWITCH81The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4766} WEIGHT81A weight value for a given contact, by default is 1=0.00325733
   ATOMS82the atoms involved in each of the contacts you wish to calculate=309,1506 SWITCH82The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4709} WEIGHT82A weight value for a given contact, by default is 1=0.00325733
   ATOMS83the atoms involved in each of the contacts you wish to calculate=316,1513 SWITCH83The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4875} WEIGHT83A weight value for a given contact, by default is 1=0.00325733
   ATOMS84the atoms involved in each of the contacts you wish to calculate=317,1514 SWITCH84The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4933} WEIGHT84A weight value for a given contact, by default is 1=0.00325733
   ATOMS85the atoms involved in each of the contacts you wish to calculate=318,1515 SWITCH85The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4975} WEIGHT85A weight value for a given contact, by default is 1=0.00325733
   ATOMS86the atoms involved in each of the contacts you wish to calculate=320,1517 SWITCH86The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5125} WEIGHT86A weight value for a given contact, by default is 1=0.00325733
   ATOMS87the atoms involved in each of the contacts you wish to calculate=335,1532 SWITCH87The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5220} WEIGHT87A weight value for a given contact, by default is 1=0.00325733
   ATOMS88the atoms involved in each of the contacts you wish to calculate=336,1533 SWITCH88The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5913} WEIGHT88A weight value for a given contact, by default is 1=0.00325733
   ATOMS89the atoms involved in each of the contacts you wish to calculate=337,1534 SWITCH89The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4467} WEIGHT89A weight value for a given contact, by default is 1=0.00325733
   ATOMS90the atoms involved in each of the contacts you wish to calculate=339,1536 SWITCH90The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4338} WEIGHT90A weight value for a given contact, by default is 1=0.00325733
   ATOMS91the atoms involved in each of the contacts you wish to calculate=342,1539 SWITCH91The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4572} WEIGHT91A weight value for a given contact, by default is 1=0.00325733
   ATOMS92the atoms involved in each of the contacts you wish to calculate=343,1540 SWITCH92The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4848} WEIGHT92A weight value for a given contact, by default is 1=0.00325733
   ATOMS93the atoms involved in each of the contacts you wish to calculate=344,1541 SWITCH93The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4540} WEIGHT93A weight value for a given contact, by default is 1=0.00325733
   ATOMS94the atoms involved in each of the contacts you wish to calculate=346,1543 SWITCH94The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4688} WEIGHT94A weight value for a given contact, by default is 1=0.00325733
   ATOMS95the atoms involved in each of the contacts you wish to calculate=356,1553 SWITCH95The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4806} WEIGHT95A weight value for a given contact, by default is 1=0.00325733
   ATOMS96the atoms involved in each of the contacts you wish to calculate=357,1554 SWITCH96The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4824} WEIGHT96A weight value for a given contact, by default is 1=0.00325733
   ATOMS97the atoms involved in each of the contacts you wish to calculate=358,1555 SWITCH97The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4873} WEIGHT97A weight value for a given contact, by default is 1=0.00325733
   ATOMS98the atoms involved in each of the contacts you wish to calculate=360,1557 SWITCH98The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4920} WEIGHT98A weight value for a given contact, by default is 1=0.00325733
   ATOMS99the atoms involved in each of the contacts you wish to calculate=375,1572 SWITCH99The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4875} WEIGHT99A weight value for a given contact, by default is 1=0.00325733
   ATOMS100the atoms involved in each of the contacts you wish to calculate=376,1573 SWITCH100The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4871} WEIGHT100A weight value for a given contact, by default is 1=0.00325733
   ATOMS101the atoms involved in each of the contacts you wish to calculate=377,1574 SWITCH101The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4830} WEIGHT101A weight value for a given contact, by default is 1=0.00325733
   ATOMS102the atoms involved in each of the contacts you wish to calculate=379,1576 SWITCH102The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4756} WEIGHT102A weight value for a given contact, by default is 1=0.00325733
   ATOMS103the atoms involved in each of the contacts you wish to calculate=392,1589 SWITCH103The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4853} WEIGHT103A weight value for a given contact, by default is 1=0.00325733
   ATOMS104the atoms involved in each of the contacts you wish to calculate=393,1590 SWITCH104The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4879} WEIGHT104A weight value for a given contact, by default is 1=0.00325733
   ATOMS105the atoms involved in each of the contacts you wish to calculate=394,1591 SWITCH105The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4925} WEIGHT105A weight value for a given contact, by default is 1=0.00325733
   ATOMS106the atoms involved in each of the contacts you wish to calculate=396,1593 SWITCH106The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5042} WEIGHT106A weight value for a given contact, by default is 1=0.00325733
   ATOMS107the atoms involved in each of the contacts you wish to calculate=409,1606 SWITCH107The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4995} WEIGHT107A weight value for a given contact, by default is 1=0.00325733
   ATOMS108the atoms involved in each of the contacts you wish to calculate=410,1607 SWITCH108The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4991} WEIGHT108A weight value for a given contact, by default is 1=0.00325733
   ATOMS109the atoms involved in each of the contacts you wish to calculate=411,1608 SWITCH109The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4983} WEIGHT109A weight value for a given contact, by default is 1=0.00325733
   ATOMS110the atoms involved in each of the contacts you wish to calculate=413,1610 SWITCH110The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4973} WEIGHT110A weight value for a given contact, by default is 1=0.00325733
   ATOMS111the atoms involved in each of the contacts you wish to calculate=431,1628 SWITCH111The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5092} WEIGHT111A weight value for a given contact, by default is 1=0.00325733
   ATOMS112the atoms involved in each of the contacts you wish to calculate=432,1629 SWITCH112The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5203} WEIGHT112A weight value for a given contact, by default is 1=0.00325733
   ATOMS113the atoms involved in each of the contacts you wish to calculate=433,1630 SWITCH113The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5051} WEIGHT113A weight value for a given contact, by default is 1=0.00325733
   ATOMS114the atoms involved in each of the contacts you wish to calculate=437,1634 SWITCH114The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5069} WEIGHT114A weight value for a given contact, by default is 1=0.00325733
   ATOMS115the atoms involved in each of the contacts you wish to calculate=445,1642 SWITCH115The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4939} WEIGHT115A weight value for a given contact, by default is 1=0.00325733
   ATOMS116the atoms involved in each of the contacts you wish to calculate=446,1643 SWITCH116The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4930} WEIGHT116A weight value for a given contact, by default is 1=0.00325733
   ATOMS117the atoms involved in each of the contacts you wish to calculate=447,1644 SWITCH117The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4862} WEIGHT117A weight value for a given contact, by default is 1=0.00325733
   ATOMS118the atoms involved in each of the contacts you wish to calculate=449,1646 SWITCH118The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4773} WEIGHT118A weight value for a given contact, by default is 1=0.00325733
   ATOMS119the atoms involved in each of the contacts you wish to calculate=452,1649 SWITCH119The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4940} WEIGHT119A weight value for a given contact, by default is 1=0.00325733
   ATOMS120the atoms involved in each of the contacts you wish to calculate=453,1650 SWITCH120The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4990} WEIGHT120A weight value for a given contact, by default is 1=0.00325733
   ATOMS121the atoms involved in each of the contacts you wish to calculate=454,1651 SWITCH121The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5027} WEIGHT121A weight value for a given contact, by default is 1=0.00325733
   ATOMS122the atoms involved in each of the contacts you wish to calculate=456,1653 SWITCH122The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5196} WEIGHT122A weight value for a given contact, by default is 1=0.00325733
   ATOMS123the atoms involved in each of the contacts you wish to calculate=459,1656 SWITCH123The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4973} WEIGHT123A weight value for a given contact, by default is 1=0.00325733
   ATOMS124the atoms involved in each of the contacts you wish to calculate=460,1657 SWITCH124The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4617} WEIGHT124A weight value for a given contact, by default is 1=0.00325733
   ATOMS125the atoms involved in each of the contacts you wish to calculate=461,1658 SWITCH125The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5222} WEIGHT125A weight value for a given contact, by default is 1=0.00325733
   ATOMS126the atoms involved in each of the contacts you wish to calculate=463,1660 SWITCH126The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5080} WEIGHT126A weight value for a given contact, by default is 1=0.00325733
   ATOMS127the atoms involved in each of the contacts you wish to calculate=466,1663 SWITCH127The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4990} WEIGHT127A weight value for a given contact, by default is 1=0.00325733
   ATOMS128the atoms involved in each of the contacts you wish to calculate=467,1664 SWITCH128The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5148} WEIGHT128A weight value for a given contact, by default is 1=0.00325733
   ATOMS129the atoms involved in each of the contacts you wish to calculate=468,1665 SWITCH129The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4813} WEIGHT129A weight value for a given contact, by default is 1=0.00325733
   ATOMS130the atoms involved in each of the contacts you wish to calculate=470,1667 SWITCH130The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4805} WEIGHT130A weight value for a given contact, by default is 1=0.00325733
   ATOMS131the atoms involved in each of the contacts you wish to calculate=483,1680 SWITCH131The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4781} WEIGHT131A weight value for a given contact, by default is 1=0.00325733
   ATOMS132the atoms involved in each of the contacts you wish to calculate=484,1681 SWITCH132The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4783} WEIGHT132A weight value for a given contact, by default is 1=0.00325733
   ATOMS133the atoms involved in each of the contacts you wish to calculate=485,1682 SWITCH133The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4735} WEIGHT133A weight value for a given contact, by default is 1=0.00325733
   ATOMS134the atoms involved in each of the contacts you wish to calculate=487,1684 SWITCH134The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4660} WEIGHT134A weight value for a given contact, by default is 1=0.00325733
   ATOMS135the atoms involved in each of the contacts you wish to calculate=499,1696 SWITCH135The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4810} WEIGHT135A weight value for a given contact, by default is 1=0.00325733
   ATOMS136the atoms involved in each of the contacts you wish to calculate=500,1697 SWITCH136The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4871} WEIGHT136A weight value for a given contact, by default is 1=0.00325733
   ATOMS137the atoms involved in each of the contacts you wish to calculate=501,1698 SWITCH137The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4882} WEIGHT137A weight value for a given contact, by default is 1=0.00325733
   ATOMS138the atoms involved in each of the contacts you wish to calculate=503,1700 SWITCH138The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5021} WEIGHT138A weight value for a given contact, by default is 1=0.00325733
   ATOMS139the atoms involved in each of the contacts you wish to calculate=514,1711 SWITCH139The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4885} WEIGHT139A weight value for a given contact, by default is 1=0.00325733
   ATOMS140the atoms involved in each of the contacts you wish to calculate=515,1712 SWITCH140The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4841} WEIGHT140A weight value for a given contact, by default is 1=0.00325733
   ATOMS141the atoms involved in each of the contacts you wish to calculate=516,1713 SWITCH141The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4858} WEIGHT141A weight value for a given contact, by default is 1=0.00325733
   ATOMS142the atoms involved in each of the contacts you wish to calculate=518,1715 SWITCH142The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4782} WEIGHT142A weight value for a given contact, by default is 1=0.00325733
   ATOMS143the atoms involved in each of the contacts you wish to calculate=530,1727 SWITCH143The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4828} WEIGHT143A weight value for a given contact, by default is 1=0.00325733
   ATOMS144the atoms involved in each of the contacts you wish to calculate=531,1728 SWITCH144The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4839} WEIGHT144A weight value for a given contact, by default is 1=0.00325733
   ATOMS145the atoms involved in each of the contacts you wish to calculate=532,1729 SWITCH145The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4850} WEIGHT145A weight value for a given contact, by default is 1=0.00325733
   ATOMS146the atoms involved in each of the contacts you wish to calculate=534,1731 SWITCH146The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4889} WEIGHT146A weight value for a given contact, by default is 1=0.00325733
   ATOMS147the atoms involved in each of the contacts you wish to calculate=552,1749 SWITCH147The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4871} WEIGHT147A weight value for a given contact, by default is 1=0.00325733
   ATOMS148the atoms involved in each of the contacts you wish to calculate=553,1750 SWITCH148The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4853} WEIGHT148A weight value for a given contact, by default is 1=0.00325733
   ATOMS149the atoms involved in each of the contacts you wish to calculate=554,1751 SWITCH149The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4887} WEIGHT149A weight value for a given contact, by default is 1=0.00325733
   ATOMS150the atoms involved in each of the contacts you wish to calculate=556,1753 SWITCH150The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4947} WEIGHT150A weight value for a given contact, by default is 1=0.00325733
   ATOMS151the atoms involved in each of the contacts you wish to calculate=563,1760 SWITCH151The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4856} WEIGHT151A weight value for a given contact, by default is 1=0.00325733
   ATOMS152the atoms involved in each of the contacts you wish to calculate=564,1761 SWITCH152The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4779} WEIGHT152A weight value for a given contact, by default is 1=0.00325733
   ATOMS153the atoms involved in each of the contacts you wish to calculate=565,1762 SWITCH153The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4901} WEIGHT153A weight value for a given contact, by default is 1=0.00325733
   ATOMS154the atoms involved in each of the contacts you wish to calculate=567,1764 SWITCH154The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4998} WEIGHT154A weight value for a given contact, by default is 1=0.00325733
   ATOMS155the atoms involved in each of the contacts you wish to calculate=578,1775 SWITCH155The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4903} WEIGHT155A weight value for a given contact, by default is 1=0.00325733
   ATOMS156the atoms involved in each of the contacts you wish to calculate=579,1776 SWITCH156The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4882} WEIGHT156A weight value for a given contact, by default is 1=0.00325733
   ATOMS157the atoms involved in each of the contacts you wish to calculate=580,1777 SWITCH157The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4902} WEIGHT157A weight value for a given contact, by default is 1=0.00325733
   ATOMS158the atoms involved in each of the contacts you wish to calculate=582,1779 SWITCH158The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4925} WEIGHT158A weight value for a given contact, by default is 1=0.00325733
   ATOMS159the atoms involved in each of the contacts you wish to calculate=600,1797 SWITCH159The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4863} WEIGHT159A weight value for a given contact, by default is 1=0.00325733
   ATOMS160the atoms involved in each of the contacts you wish to calculate=601,1798 SWITCH160The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4853} WEIGHT160A weight value for a given contact, by default is 1=0.00325733
   ATOMS161the atoms involved in each of the contacts you wish to calculate=602,1799 SWITCH161The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4839} WEIGHT161A weight value for a given contact, by default is 1=0.00325733
   ATOMS162the atoms involved in each of the contacts you wish to calculate=604,1801 SWITCH162The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4803} WEIGHT162A weight value for a given contact, by default is 1=0.00325733
   ATOMS163the atoms involved in each of the contacts you wish to calculate=619,1816 SWITCH163The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4804} WEIGHT163A weight value for a given contact, by default is 1=0.00325733
   ATOMS164the atoms involved in each of the contacts you wish to calculate=620,1817 SWITCH164The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4802} WEIGHT164A weight value for a given contact, by default is 1=0.00325733
   ATOMS165the atoms involved in each of the contacts you wish to calculate=621,1818 SWITCH165The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4805} WEIGHT165A weight value for a given contact, by default is 1=0.00325733
   ATOMS166the atoms involved in each of the contacts you wish to calculate=623,1820 SWITCH166The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4779} WEIGHT166A weight value for a given contact, by default is 1=0.00325733
   ATOMS167the atoms involved in each of the contacts you wish to calculate=631,1828 SWITCH167The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4809} WEIGHT167A weight value for a given contact, by default is 1=0.00325733
   ATOMS168the atoms involved in each of the contacts you wish to calculate=632,1829 SWITCH168The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4804} WEIGHT168A weight value for a given contact, by default is 1=0.00325733
   ATOMS169the atoms involved in each of the contacts you wish to calculate=633,1830 SWITCH169The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4820} WEIGHT169A weight value for a given contact, by default is 1=0.00325733
   ATOMS170the atoms involved in each of the contacts you wish to calculate=635,1832 SWITCH170The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4806} WEIGHT170A weight value for a given contact, by default is 1=0.00325733
   ATOMS171the atoms involved in each of the contacts you wish to calculate=651,1848 SWITCH171The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4782} WEIGHT171A weight value for a given contact, by default is 1=0.00325733
   ATOMS172the atoms involved in each of the contacts you wish to calculate=652,1849 SWITCH172The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4785} WEIGHT172A weight value for a given contact, by default is 1=0.00325733
   ATOMS173the atoms involved in each of the contacts you wish to calculate=653,1850 SWITCH173The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4792} WEIGHT173A weight value for a given contact, by default is 1=0.00325733
   ATOMS174the atoms involved in each of the contacts you wish to calculate=655,1852 SWITCH174The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4810} WEIGHT174A weight value for a given contact, by default is 1=0.00325733
   ATOMS175the atoms involved in each of the contacts you wish to calculate=673,1870 SWITCH175The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4826} WEIGHT175A weight value for a given contact, by default is 1=0.00325733
   ATOMS176the atoms involved in each of the contacts you wish to calculate=674,1871 SWITCH176The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4839} WEIGHT176A weight value for a given contact, by default is 1=0.00325733
   ATOMS177the atoms involved in each of the contacts you wish to calculate=675,1872 SWITCH177The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4863} WEIGHT177A weight value for a given contact, by default is 1=0.00325733
   ATOMS178the atoms involved in each of the contacts you wish to calculate=677,1874 SWITCH178The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4922} WEIGHT178A weight value for a given contact, by default is 1=0.00325733
   ATOMS179the atoms involved in each of the contacts you wish to calculate=685,1882 SWITCH179The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4822} WEIGHT179A weight value for a given contact, by default is 1=0.00325733
   ATOMS180the atoms involved in each of the contacts you wish to calculate=686,1883 SWITCH180The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4786} WEIGHT180A weight value for a given contact, by default is 1=0.00325733
   ATOMS181the atoms involved in each of the contacts you wish to calculate=687,1884 SWITCH181The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4788} WEIGHT181A weight value for a given contact, by default is 1=0.00325733
   ATOMS182the atoms involved in each of the contacts you wish to calculate=689,1886 SWITCH182The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4781} WEIGHT182A weight value for a given contact, by default is 1=0.00325733
   ATOMS183the atoms involved in each of the contacts you wish to calculate=709,1906 SWITCH183The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4764} WEIGHT183A weight value for a given contact, by default is 1=0.00325733
   ATOMS184the atoms involved in each of the contacts you wish to calculate=710,1907 SWITCH184The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4802} WEIGHT184A weight value for a given contact, by default is 1=0.00325733
   ATOMS185the atoms involved in each of the contacts you wish to calculate=711,1908 SWITCH185The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4720} WEIGHT185A weight value for a given contact, by default is 1=0.00325733
   ATOMS186the atoms involved in each of the contacts you wish to calculate=713,1910 SWITCH186The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4724} WEIGHT186A weight value for a given contact, by default is 1=0.00325733
   ATOMS187the atoms involved in each of the contacts you wish to calculate=725,1922 SWITCH187The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4755} WEIGHT187A weight value for a given contact, by default is 1=0.00325733
   ATOMS188the atoms involved in each of the contacts you wish to calculate=726,1923 SWITCH188The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4767} WEIGHT188A weight value for a given contact, by default is 1=0.00325733
   ATOMS189the atoms involved in each of the contacts you wish to calculate=727,1924 SWITCH189The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4797} WEIGHT189A weight value for a given contact, by default is 1=0.00325733
   ATOMS190the atoms involved in each of the contacts you wish to calculate=729,1926 SWITCH190The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4860} WEIGHT190A weight value for a given contact, by default is 1=0.00325733
   ATOMS191the atoms involved in each of the contacts you wish to calculate=742,1939 SWITCH191The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4847} WEIGHT191A weight value for a given contact, by default is 1=0.00325733
   ATOMS192the atoms involved in each of the contacts you wish to calculate=743,1940 SWITCH192The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4849} WEIGHT192A weight value for a given contact, by default is 1=0.00325733
   ATOMS193the atoms involved in each of the contacts you wish to calculate=744,1941 SWITCH193The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4824} WEIGHT193A weight value for a given contact, by default is 1=0.00325733
   ATOMS194the atoms involved in each of the contacts you wish to calculate=746,1943 SWITCH194The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4800} WEIGHT194A weight value for a given contact, by default is 1=0.00325733
   ATOMS195the atoms involved in each of the contacts you wish to calculate=753,1950 SWITCH195The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4865} WEIGHT195A weight value for a given contact, by default is 1=0.00325733
   ATOMS196the atoms involved in each of the contacts you wish to calculate=754,1951 SWITCH196The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4859} WEIGHT196A weight value for a given contact, by default is 1=0.00325733
   ATOMS197the atoms involved in each of the contacts you wish to calculate=755,1952 SWITCH197The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4903} WEIGHT197A weight value for a given contact, by default is 1=0.00325733
   ATOMS198the atoms involved in each of the contacts you wish to calculate=757,1954 SWITCH198The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4960} WEIGHT198A weight value for a given contact, by default is 1=0.00325733
   ATOMS199the atoms involved in each of the contacts you wish to calculate=775,1972 SWITCH199The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4890} WEIGHT199A weight value for a given contact, by default is 1=0.00325733
   ATOMS200the atoms involved in each of the contacts you wish to calculate=776,1973 SWITCH200The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4869} WEIGHT200A weight value for a given contact, by default is 1=0.00325733
   ATOMS201the atoms involved in each of the contacts you wish to calculate=777,1974 SWITCH201The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4842} WEIGHT201A weight value for a given contact, by default is 1=0.00325733
   ATOMS202the atoms involved in each of the contacts you wish to calculate=779,1976 SWITCH202The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4728} WEIGHT202A weight value for a given contact, by default is 1=0.00325733
   ATOMS203the atoms involved in each of the contacts you wish to calculate=794,1991 SWITCH203The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4732} WEIGHT203A weight value for a given contact, by default is 1=0.00325733
   ATOMS204the atoms involved in each of the contacts you wish to calculate=795,1992 SWITCH204The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4752} WEIGHT204A weight value for a given contact, by default is 1=0.00325733
   ATOMS205the atoms involved in each of the contacts you wish to calculate=796,1993 SWITCH205The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4729} WEIGHT205A weight value for a given contact, by default is 1=0.00325733
   ATOMS206the atoms involved in each of the contacts you wish to calculate=798,1995 SWITCH206The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4700} WEIGHT206A weight value for a given contact, by default is 1=0.00325733
   ATOMS207the atoms involved in each of the contacts you wish to calculate=801,1998 SWITCH207The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4671} WEIGHT207A weight value for a given contact, by default is 1=0.00325733
   ATOMS208the atoms involved in each of the contacts you wish to calculate=802,1999 SWITCH208The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4934} WEIGHT208A weight value for a given contact, by default is 1=0.00325733
   ATOMS209the atoms involved in each of the contacts you wish to calculate=803,2000 SWITCH209The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4543} WEIGHT209A weight value for a given contact, by default is 1=0.00325733
   ATOMS210the atoms involved in each of the contacts you wish to calculate=805,2002 SWITCH210The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4593} WEIGHT210A weight value for a given contact, by default is 1=0.00325733
   ATOMS211the atoms involved in each of the contacts you wish to calculate=812,2009 SWITCH211The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4710} WEIGHT211A weight value for a given contact, by default is 1=0.00325733
   ATOMS212the atoms involved in each of the contacts you wish to calculate=813,2010 SWITCH212The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4789} WEIGHT212A weight value for a given contact, by default is 1=0.00325733
   ATOMS213the atoms involved in each of the contacts you wish to calculate=814,2011 SWITCH213The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4804} WEIGHT213A weight value for a given contact, by default is 1=0.00325733
   ATOMS214the atoms involved in each of the contacts you wish to calculate=816,2013 SWITCH214The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4870} WEIGHT214A weight value for a given contact, by default is 1=0.00325733
   ATOMS215the atoms involved in each of the contacts you wish to calculate=831,2028 SWITCH215The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4920} WEIGHT215A weight value for a given contact, by default is 1=0.00325733
   ATOMS216the atoms involved in each of the contacts you wish to calculate=832,2029 SWITCH216The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4961} WEIGHT216A weight value for a given contact, by default is 1=0.00325733
   ATOMS217the atoms involved in each of the contacts you wish to calculate=833,2030 SWITCH217The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4910} WEIGHT217A weight value for a given contact, by default is 1=0.00325733
   ATOMS218the atoms involved in each of the contacts you wish to calculate=835,2032 SWITCH218The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4905} WEIGHT218A weight value for a given contact, by default is 1=0.00325733
   ATOMS219the atoms involved in each of the contacts you wish to calculate=843,2040 SWITCH219The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4813} WEIGHT219A weight value for a given contact, by default is 1=0.00325733
   ATOMS220the atoms involved in each of the contacts you wish to calculate=844,2041 SWITCH220The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4769} WEIGHT220A weight value for a given contact, by default is 1=0.00325733
   ATOMS221the atoms involved in each of the contacts you wish to calculate=845,2042 SWITCH221The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4816} WEIGHT221A weight value for a given contact, by default is 1=0.00325733
   ATOMS222the atoms involved in each of the contacts you wish to calculate=847,2044 SWITCH222The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4697} WEIGHT222A weight value for a given contact, by default is 1=0.00325733
   ATOMS223the atoms involved in each of the contacts you wish to calculate=857,2054 SWITCH223The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4728} WEIGHT223A weight value for a given contact, by default is 1=0.00325733
   ATOMS224the atoms involved in each of the contacts you wish to calculate=858,2055 SWITCH224The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4777} WEIGHT224A weight value for a given contact, by default is 1=0.00325733
   ATOMS225the atoms involved in each of the contacts you wish to calculate=859,2056 SWITCH225The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4715} WEIGHT225A weight value for a given contact, by default is 1=0.00325733
   ATOMS226the atoms involved in each of the contacts you wish to calculate=861,2058 SWITCH226The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4717} WEIGHT226A weight value for a given contact, by default is 1=0.00325733
   ATOMS227the atoms involved in each of the contacts you wish to calculate=876,2073 SWITCH227The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4745} WEIGHT227A weight value for a given contact, by default is 1=0.00325733
   ATOMS228the atoms involved in each of the contacts you wish to calculate=877,2074 SWITCH228The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4741} WEIGHT228A weight value for a given contact, by default is 1=0.00325733
   ATOMS229the atoms involved in each of the contacts you wish to calculate=878,2075 SWITCH229The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4779} WEIGHT229A weight value for a given contact, by default is 1=0.00325733
   ATOMS230the atoms involved in each of the contacts you wish to calculate=880,2077 SWITCH230The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4804} WEIGHT230A weight value for a given contact, by default is 1=0.00325733
   ATOMS231the atoms involved in each of the contacts you wish to calculate=890,2087 SWITCH231The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4825} WEIGHT231A weight value for a given contact, by default is 1=0.00325733
   ATOMS232the atoms involved in each of the contacts you wish to calculate=891,2088 SWITCH232The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4847} WEIGHT232A weight value for a given contact, by default is 1=0.00325733
   ATOMS233the atoms involved in each of the contacts you wish to calculate=892,2089 SWITCH233The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4842} WEIGHT233A weight value for a given contact, by default is 1=0.00325733
   ATOMS234the atoms involved in each of the contacts you wish to calculate=894,2091 SWITCH234The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4866} WEIGHT234A weight value for a given contact, by default is 1=0.00325733
   ATOMS235the atoms involved in each of the contacts you wish to calculate=907,2104 SWITCH235The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4913} WEIGHT235A weight value for a given contact, by default is 1=0.00325733
   ATOMS236the atoms involved in each of the contacts you wish to calculate=908,2105 SWITCH236The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4919} WEIGHT236A weight value for a given contact, by default is 1=0.00325733
   ATOMS237the atoms involved in each of the contacts you wish to calculate=909,2106 SWITCH237The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4951} WEIGHT237A weight value for a given contact, by default is 1=0.00325733
   ATOMS238the atoms involved in each of the contacts you wish to calculate=911,2108 SWITCH238The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5010} WEIGHT238A weight value for a given contact, by default is 1=0.00325733
   ATOMS239the atoms involved in each of the contacts you wish to calculate=923,2120 SWITCH239The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5001} WEIGHT239A weight value for a given contact, by default is 1=0.00325733
   ATOMS240the atoms involved in each of the contacts you wish to calculate=924,2121 SWITCH240The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4838} WEIGHT240A weight value for a given contact, by default is 1=0.00325733
   ATOMS241the atoms involved in each of the contacts you wish to calculate=925,2122 SWITCH241The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5252} WEIGHT241A weight value for a given contact, by default is 1=0.00325733
   ATOMS242the atoms involved in each of the contacts you wish to calculate=929,2126 SWITCH242The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5097} WEIGHT242A weight value for a given contact, by default is 1=0.00325733
   ATOMS243the atoms involved in each of the contacts you wish to calculate=937,2134 SWITCH243The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4992} WEIGHT243A weight value for a given contact, by default is 1=0.00325733
   ATOMS244the atoms involved in each of the contacts you wish to calculate=938,2135 SWITCH244The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4967} WEIGHT244A weight value for a given contact, by default is 1=0.00325733
   ATOMS245the atoms involved in each of the contacts you wish to calculate=939,2136 SWITCH245The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4930} WEIGHT245A weight value for a given contact, by default is 1=0.00325733
   ATOMS246the atoms involved in each of the contacts you wish to calculate=941,2138 SWITCH246The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4843} WEIGHT246A weight value for a given contact, by default is 1=0.00325733
   ATOMS247the atoms involved in each of the contacts you wish to calculate=944,2141 SWITCH247The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4918} WEIGHT247A weight value for a given contact, by default is 1=0.00325733
   ATOMS248the atoms involved in each of the contacts you wish to calculate=945,2142 SWITCH248The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5012} WEIGHT248A weight value for a given contact, by default is 1=0.00325733
   ATOMS249the atoms involved in each of the contacts you wish to calculate=946,2143 SWITCH249The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4862} WEIGHT249A weight value for a given contact, by default is 1=0.00325733
   ATOMS250the atoms involved in each of the contacts you wish to calculate=948,2145 SWITCH250The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4951} WEIGHT250A weight value for a given contact, by default is 1=0.00325733
   ATOMS251the atoms involved in each of the contacts you wish to calculate=951,2148 SWITCH251The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4720} WEIGHT251A weight value for a given contact, by default is 1=0.00325733
   ATOMS252the atoms involved in each of the contacts you wish to calculate=952,2149 SWITCH252The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4829} WEIGHT252A weight value for a given contact, by default is 1=0.00325733
   ATOMS253the atoms involved in each of the contacts you wish to calculate=953,2150 SWITCH253The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4433} WEIGHT253A weight value for a given contact, by default is 1=0.00325733
   ATOMS254the atoms involved in each of the contacts you wish to calculate=955,2152 SWITCH254The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4129} WEIGHT254A weight value for a given contact, by default is 1=0.00325733
   ATOMS255the atoms involved in each of the contacts you wish to calculate=958,2155 SWITCH255The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4409} WEIGHT255A weight value for a given contact, by default is 1=0.00325733
   ATOMS256the atoms involved in each of the contacts you wish to calculate=959,2156 SWITCH256The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4617} WEIGHT256A weight value for a given contact, by default is 1=0.00325733
   ATOMS257the atoms involved in each of the contacts you wish to calculate=960,2157 SWITCH257The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4424} WEIGHT257A weight value for a given contact, by default is 1=0.00325733
   ATOMS258the atoms involved in each of the contacts you wish to calculate=962,2159 SWITCH258The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4613} WEIGHT258A weight value for a given contact, by default is 1=0.00325733
   ATOMS259the atoms involved in each of the contacts you wish to calculate=972,2169 SWITCH259The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4768} WEIGHT259A weight value for a given contact, by default is 1=0.00325733
   ATOMS260the atoms involved in each of the contacts you wish to calculate=973,2170 SWITCH260The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4870} WEIGHT260A weight value for a given contact, by default is 1=0.00325733
   ATOMS261the atoms involved in each of the contacts you wish to calculate=974,2171 SWITCH261The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4814} WEIGHT261A weight value for a given contact, by default is 1=0.00325733
   ATOMS262the atoms involved in each of the contacts you wish to calculate=976,2173 SWITCH262The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4930} WEIGHT262A weight value for a given contact, by default is 1=0.00325733
   ATOMS263the atoms involved in each of the contacts you wish to calculate=994,2191 SWITCH263The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4930} WEIGHT263A weight value for a given contact, by default is 1=0.00325733
   ATOMS264the atoms involved in each of the contacts you wish to calculate=995,2192 SWITCH264The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4912} WEIGHT264A weight value for a given contact, by default is 1=0.00325733
   ATOMS265the atoms involved in each of the contacts you wish to calculate=996,2193 SWITCH265The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4957} WEIGHT265A weight value for a given contact, by default is 1=0.00325733
   ATOMS266the atoms involved in each of the contacts you wish to calculate=998,2195 SWITCH266The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4977} WEIGHT266A weight value for a given contact, by default is 1=0.00325733
   ATOMS267the atoms involved in each of the contacts you wish to calculate=1016,2213 SWITCH267The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4930} WEIGHT267A weight value for a given contact, by default is 1=0.00325733
   ATOMS268the atoms involved in each of the contacts you wish to calculate=1017,2214 SWITCH268The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4923} WEIGHT268A weight value for a given contact, by default is 1=0.00325733
   ATOMS269the atoms involved in each of the contacts you wish to calculate=1018,2215 SWITCH269The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4904} WEIGHT269A weight value for a given contact, by default is 1=0.00325733
   ATOMS270the atoms involved in each of the contacts you wish to calculate=1020,2217 SWITCH270The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4853} WEIGHT270A weight value for a given contact, by default is 1=0.00325733
   ATOMS271the atoms involved in each of the contacts you wish to calculate=1035,2232 SWITCH271The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4836} WEIGHT271A weight value for a given contact, by default is 1=0.00325733
   ATOMS272the atoms involved in each of the contacts you wish to calculate=1036,2233 SWITCH272The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4832} WEIGHT272A weight value for a given contact, by default is 1=0.00325733
   ATOMS273the atoms involved in each of the contacts you wish to calculate=1037,2234 SWITCH273The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4845} WEIGHT273A weight value for a given contact, by default is 1=0.00325733
   ATOMS274the atoms involved in each of the contacts you wish to calculate=1039,2236 SWITCH274The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4875} WEIGHT274A weight value for a given contact, by default is 1=0.00325733
   ATOMS275the atoms involved in each of the contacts you wish to calculate=1050,2247 SWITCH275The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4785} WEIGHT275A weight value for a given contact, by default is 1=0.00325733
   ATOMS276the atoms involved in each of the contacts you wish to calculate=1051,2248 SWITCH276The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4777} WEIGHT276A weight value for a given contact, by default is 1=0.00325733
   ATOMS277the atoms involved in each of the contacts you wish to calculate=1052,2249 SWITCH277The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4733} WEIGHT277A weight value for a given contact, by default is 1=0.00325733
   ATOMS278the atoms involved in each of the contacts you wish to calculate=1054,2251 SWITCH278The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4641} WEIGHT278A weight value for a given contact, by default is 1=0.00325733
   ATOMS279the atoms involved in each of the contacts you wish to calculate=1064,2261 SWITCH279The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4697} WEIGHT279A weight value for a given contact, by default is 1=0.00325733
   ATOMS280the atoms involved in each of the contacts you wish to calculate=1065,2262 SWITCH280The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4777} WEIGHT280A weight value for a given contact, by default is 1=0.00325733
   ATOMS281the atoms involved in each of the contacts you wish to calculate=1066,2263 SWITCH281The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4753} WEIGHT281A weight value for a given contact, by default is 1=0.00325733
   ATOMS282the atoms involved in each of the contacts you wish to calculate=1068,2265 SWITCH282The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4857} WEIGHT282A weight value for a given contact, by default is 1=0.00325733
   ATOMS283the atoms involved in each of the contacts you wish to calculate=1081,2278 SWITCH283The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4895} WEIGHT283A weight value for a given contact, by default is 1=0.00325733
   ATOMS284the atoms involved in each of the contacts you wish to calculate=1082,2279 SWITCH284The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4949} WEIGHT284A weight value for a given contact, by default is 1=0.00325733
   ATOMS285the atoms involved in each of the contacts you wish to calculate=1083,2280 SWITCH285The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4878} WEIGHT285A weight value for a given contact, by default is 1=0.00325733
   ATOMS286the atoms involved in each of the contacts you wish to calculate=1085,2282 SWITCH286The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4951} WEIGHT286A weight value for a given contact, by default is 1=0.00325733
   ATOMS287the atoms involved in each of the contacts you wish to calculate=1103,2300 SWITCH287The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4865} WEIGHT287A weight value for a given contact, by default is 1=0.00325733
   ATOMS288the atoms involved in each of the contacts you wish to calculate=1104,2301 SWITCH288The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4850} WEIGHT288A weight value for a given contact, by default is 1=0.00325733
   ATOMS289the atoms involved in each of the contacts you wish to calculate=1105,2302 SWITCH289The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4861} WEIGHT289A weight value for a given contact, by default is 1=0.00325733
   ATOMS290the atoms involved in each of the contacts you wish to calculate=1107,2304 SWITCH290The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4850} WEIGHT290A weight value for a given contact, by default is 1=0.00325733
   ATOMS291the atoms involved in each of the contacts you wish to calculate=1122,2319 SWITCH291The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4880} WEIGHT291A weight value for a given contact, by default is 1=0.00325733
   ATOMS292the atoms involved in each of the contacts you wish to calculate=1123,2320 SWITCH292The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4892} WEIGHT292A weight value for a given contact, by default is 1=0.00325733
   ATOMS293the atoms involved in each of the contacts you wish to calculate=1124,2321 SWITCH293The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4897} WEIGHT293A weight value for a given contact, by default is 1=0.00325733
   ATOMS294the atoms involved in each of the contacts you wish to calculate=1126,2323 SWITCH294The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4930} WEIGHT294A weight value for a given contact, by default is 1=0.00325733
   ATOMS295the atoms involved in each of the contacts you wish to calculate=1136,2333 SWITCH295The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4890} WEIGHT295A weight value for a given contact, by default is 1=0.00325733
   ATOMS296the atoms involved in each of the contacts you wish to calculate=1137,2334 SWITCH296The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4877} WEIGHT296A weight value for a given contact, by default is 1=0.00325733
   ATOMS297the atoms involved in each of the contacts you wish to calculate=1138,2335 SWITCH297The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4863} WEIGHT297A weight value for a given contact, by default is 1=0.00325733
   ATOMS298the atoms involved in each of the contacts you wish to calculate=1140,2337 SWITCH298The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4835} WEIGHT298A weight value for a given contact, by default is 1=0.00325733
   ATOMS299the atoms involved in each of the contacts you wish to calculate=1156,2353 SWITCH299The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5016} WEIGHT299A weight value for a given contact, by default is 1=0.00325733
   ATOMS300the atoms involved in each of the contacts you wish to calculate=1157,2354 SWITCH300The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5108} WEIGHT300A weight value for a given contact, by default is 1=0.00325733
   ATOMS301the atoms involved in each of the contacts you wish to calculate=1158,2355 SWITCH301The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5095} WEIGHT301A weight value for a given contact, by default is 1=0.00325733
   ATOMS302the atoms involved in each of the contacts you wish to calculate=1160,2357 SWITCH302The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5329} WEIGHT302A weight value for a given contact, by default is 1=0.00325733
   ATOMS303the atoms involved in each of the contacts you wish to calculate=1180,2377 SWITCH303The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5428} WEIGHT303A weight value for a given contact, by default is 1=0.00325733
   ATOMS304the atoms involved in each of the contacts you wish to calculate=1181,2378 SWITCH304The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5258} WEIGHT304A weight value for a given contact, by default is 1=0.00325733
   ATOMS305the atoms involved in each of the contacts you wish to calculate=1182,2379 SWITCH305The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5792} WEIGHT305A weight value for a given contact, by default is 1=0.00325733
   ATOMS306the atoms involved in each of the contacts you wish to calculate=1184,2381 SWITCH306The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.6320} WEIGHT306A weight value for a given contact, by default is 1=0.00325733
   ATOMS307the atoms involved in each of the contacts you wish to calculate=1195,2392 SWITCH307The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.7222} WEIGHT307A weight value for a given contact, by default is 1=0.00325733

   SUM calculate the sum of all the contacts in the input
...

The CONTACTMAP action with label cmapab calculates the following quantities:
 Quantity   
 Description  
cmapab.contact
By not using SUM or CMDIST each contact will be stored in a component
cmapab.value
the sum of all the switching function on all the distancescmapbc: CONTACTMAPCalculate the distances between a number of pairs of atoms and transform each distance by a switching function. More details ...
   ATOMS1the atoms involved in each of the contacts you wish to calculate=1198,2395 SWITCH1The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5293} WEIGHT1A weight value for a given contact, by default is 1=0.00325733
   ATOMS2the atoms involved in each of the contacts you wish to calculate=1202,2399 SWITCH2The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4882} WEIGHT2A weight value for a given contact, by default is 1=0.00325733
   ATOMS3the atoms involved in each of the contacts you wish to calculate=1205,2402 SWITCH3The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4817} WEIGHT3A weight value for a given contact, by default is 1=0.00325733
   ATOMS4the atoms involved in each of the contacts you wish to calculate=1206,2403 SWITCH4The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4822} WEIGHT4A weight value for a given contact, by default is 1=0.00325733
   ATOMS5the atoms involved in each of the contacts you wish to calculate=1207,2404 SWITCH5The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4778} WEIGHT5A weight value for a given contact, by default is 1=0.00325733
   ATOMS6the atoms involved in each of the contacts you wish to calculate=1209,2406 SWITCH6The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4704} WEIGHT6A weight value for a given contact, by default is 1=0.00325733
   ATOMS7the atoms involved in each of the contacts you wish to calculate=1216,2413 SWITCH7The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4757} WEIGHT7A weight value for a given contact, by default is 1=0.00325733
   ATOMS8the atoms involved in each of the contacts you wish to calculate=1217,2414 SWITCH8The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4769} WEIGHT8A weight value for a given contact, by default is 1=0.00325733
   ATOMS9the atoms involved in each of the contacts you wish to calculate=1218,2415 SWITCH9The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4811} WEIGHT9A weight value for a given contact, by default is 1=0.00325733
   ATOMS10the atoms involved in each of the contacts you wish to calculate=1220,2417 SWITCH10The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4833} WEIGHT10A weight value for a given contact, by default is 1=0.00325733
   ATOMS11the atoms involved in each of the contacts you wish to calculate=1232,2429 SWITCH11The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4839} WEIGHT11A weight value for a given contact, by default is 1=0.00325733
   ATOMS12the atoms involved in each of the contacts you wish to calculate=1233,2430 SWITCH12The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4854} WEIGHT12A weight value for a given contact, by default is 1=0.00325733
   ATOMS13the atoms involved in each of the contacts you wish to calculate=1234,2431 SWITCH13The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4823} WEIGHT13A weight value for a given contact, by default is 1=0.00325733
   ATOMS14the atoms involved in each of the contacts you wish to calculate=1236,2433 SWITCH14The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4819} WEIGHT14A weight value for a given contact, by default is 1=0.00325733
   ATOMS15the atoms involved in each of the contacts you wish to calculate=1249,2446 SWITCH15The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4786} WEIGHT15A weight value for a given contact, by default is 1=0.00325733
   ATOMS16the atoms involved in each of the contacts you wish to calculate=1250,2447 SWITCH16The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4782} WEIGHT16A weight value for a given contact, by default is 1=0.00325733
   ATOMS17the atoms involved in each of the contacts you wish to calculate=1251,2448 SWITCH17The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4772} WEIGHT17A weight value for a given contact, by default is 1=0.00325733
   ATOMS18the atoms involved in each of the contacts you wish to calculate=1253,2450 SWITCH18The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4747} WEIGHT18A weight value for a given contact, by default is 1=0.00325733
   ATOMS19the atoms involved in each of the contacts you wish to calculate=1268,2465 SWITCH19The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4774} WEIGHT19A weight value for a given contact, by default is 1=0.00325733
   ATOMS20the atoms involved in each of the contacts you wish to calculate=1269,2466 SWITCH20The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4782} WEIGHT20A weight value for a given contact, by default is 1=0.00325733
   ATOMS21the atoms involved in each of the contacts you wish to calculate=1270,2467 SWITCH21The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4779} WEIGHT21A weight value for a given contact, by default is 1=0.00325733
   ATOMS22the atoms involved in each of the contacts you wish to calculate=1272,2469 SWITCH22The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4805} WEIGHT22A weight value for a given contact, by default is 1=0.00325733
   ATOMS23the atoms involved in each of the contacts you wish to calculate=1284,2481 SWITCH23The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4806} WEIGHT23A weight value for a given contact, by default is 1=0.00325733
   ATOMS24the atoms involved in each of the contacts you wish to calculate=1285,2482 SWITCH24The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4819} WEIGHT24A weight value for a given contact, by default is 1=0.00325733
   ATOMS25the atoms involved in each of the contacts you wish to calculate=1286,2483 SWITCH25The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4839} WEIGHT25A weight value for a given contact, by default is 1=0.00325733
   ATOMS26the atoms involved in each of the contacts you wish to calculate=1288,2485 SWITCH26The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4845} WEIGHT26A weight value for a given contact, by default is 1=0.00325733
   ATOMS27the atoms involved in each of the contacts you wish to calculate=1305,2502 SWITCH27The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5003} WEIGHT27A weight value for a given contact, by default is 1=0.00325733
   ATOMS28the atoms involved in each of the contacts you wish to calculate=1306,2503 SWITCH28The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5042} WEIGHT28A weight value for a given contact, by default is 1=0.00325733
   ATOMS29the atoms involved in each of the contacts you wish to calculate=1307,2504 SWITCH29The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5117} WEIGHT29A weight value for a given contact, by default is 1=0.00325733
   ATOMS30the atoms involved in each of the contacts you wish to calculate=1309,2506 SWITCH30The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5388} WEIGHT30A weight value for a given contact, by default is 1=0.00325733
   ATOMS31the atoms involved in each of the contacts you wish to calculate=1327,2524 SWITCH31The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5347} WEIGHT31A weight value for a given contact, by default is 1=0.00325733
   ATOMS32the atoms involved in each of the contacts you wish to calculate=1328,2525 SWITCH32The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5562} WEIGHT32A weight value for a given contact, by default is 1=0.00325733
   ATOMS33the atoms involved in each of the contacts you wish to calculate=1329,2526 SWITCH33The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5120} WEIGHT33A weight value for a given contact, by default is 1=0.00325733
   ATOMS34the atoms involved in each of the contacts you wish to calculate=1333,2530 SWITCH34The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5072} WEIGHT34A weight value for a given contact, by default is 1=0.00325733
   ATOMS35the atoms involved in each of the contacts you wish to calculate=1341,2538 SWITCH35The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4993} WEIGHT35A weight value for a given contact, by default is 1=0.00325733
   ATOMS36the atoms involved in each of the contacts you wish to calculate=1342,2539 SWITCH36The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5011} WEIGHT36A weight value for a given contact, by default is 1=0.00325733
   ATOMS37the atoms involved in each of the contacts you wish to calculate=1343,2540 SWITCH37The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4947} WEIGHT37A weight value for a given contact, by default is 1=0.00325733
   ATOMS38the atoms involved in each of the contacts you wish to calculate=1345,2542 SWITCH38The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4922} WEIGHT38A weight value for a given contact, by default is 1=0.00325733
   ATOMS39the atoms involved in each of the contacts you wish to calculate=1357,2554 SWITCH39The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5012} WEIGHT39A weight value for a given contact, by default is 1=0.00325733
   ATOMS40the atoms involved in each of the contacts you wish to calculate=1358,2555 SWITCH40The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5208} WEIGHT40A weight value for a given contact, by default is 1=0.00325733
   ATOMS41the atoms involved in each of the contacts you wish to calculate=1359,2556 SWITCH41The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4938} WEIGHT41A weight value for a given contact, by default is 1=0.00325733
   ATOMS42the atoms involved in each of the contacts you wish to calculate=1361,2558 SWITCH42The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4923} WEIGHT42A weight value for a given contact, by default is 1=0.00325733
   ATOMS43the atoms involved in each of the contacts you wish to calculate=1369,2566 SWITCH43The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4950} WEIGHT43A weight value for a given contact, by default is 1=0.00325733
   ATOMS44the atoms involved in each of the contacts you wish to calculate=1370,2567 SWITCH44The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4943} WEIGHT44A weight value for a given contact, by default is 1=0.00325733
   ATOMS45the atoms involved in each of the contacts you wish to calculate=1371,2568 SWITCH45The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5034} WEIGHT45A weight value for a given contact, by default is 1=0.00325733
   ATOMS46the atoms involved in each of the contacts you wish to calculate=1373,2570 SWITCH46The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5203} WEIGHT46A weight value for a given contact, by default is 1=0.00325733
   ATOMS47the atoms involved in each of the contacts you wish to calculate=1388,2585 SWITCH47The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4961} WEIGHT47A weight value for a given contact, by default is 1=0.00325733
   ATOMS48the atoms involved in each of the contacts you wish to calculate=1389,2586 SWITCH48The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4757} WEIGHT48A weight value for a given contact, by default is 1=0.00325733
   ATOMS49the atoms involved in each of the contacts you wish to calculate=1390,2587 SWITCH49The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5026} WEIGHT49A weight value for a given contact, by default is 1=0.00325733
   ATOMS50the atoms involved in each of the contacts you wish to calculate=1392,2589 SWITCH50The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4857} WEIGHT50A weight value for a given contact, by default is 1=0.00325733
   ATOMS51the atoms involved in each of the contacts you wish to calculate=1399,2596 SWITCH51The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4791} WEIGHT51A weight value for a given contact, by default is 1=0.00325733
   ATOMS52the atoms involved in each of the contacts you wish to calculate=1400,2597 SWITCH52The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4709} WEIGHT52A weight value for a given contact, by default is 1=0.00325733
   ATOMS53the atoms involved in each of the contacts you wish to calculate=1401,2598 SWITCH53The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4873} WEIGHT53A weight value for a given contact, by default is 1=0.00325733
   ATOMS54the atoms involved in each of the contacts you wish to calculate=1403,2600 SWITCH54The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4892} WEIGHT54A weight value for a given contact, by default is 1=0.00325733
   ATOMS55the atoms involved in each of the contacts you wish to calculate=1421,2618 SWITCH55The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4832} WEIGHT55A weight value for a given contact, by default is 1=0.00325733
   ATOMS56the atoms involved in each of the contacts you wish to calculate=1422,2619 SWITCH56The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4834} WEIGHT56A weight value for a given contact, by default is 1=0.00325733
   ATOMS57the atoms involved in each of the contacts you wish to calculate=1423,2620 SWITCH57The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4795} WEIGHT57A weight value for a given contact, by default is 1=0.00325733
   ATOMS58the atoms involved in each of the contacts you wish to calculate=1425,2622 SWITCH58The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4742} WEIGHT58A weight value for a given contact, by default is 1=0.00325733
   ATOMS59the atoms involved in each of the contacts you wish to calculate=1437,2634 SWITCH59The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4768} WEIGHT59A weight value for a given contact, by default is 1=0.00325733
   ATOMS60the atoms involved in each of the contacts you wish to calculate=1438,2635 SWITCH60The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4761} WEIGHT60A weight value for a given contact, by default is 1=0.00325733
   ATOMS61the atoms involved in each of the contacts you wish to calculate=1439,2636 SWITCH61The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4757} WEIGHT61A weight value for a given contact, by default is 1=0.00325733
   ATOMS62the atoms involved in each of the contacts you wish to calculate=1441,2638 SWITCH62The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4690} WEIGHT62A weight value for a given contact, by default is 1=0.00325733
   ATOMS63the atoms involved in each of the contacts you wish to calculate=1451,2648 SWITCH63The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4763} WEIGHT63A weight value for a given contact, by default is 1=0.00325733
   ATOMS64the atoms involved in each of the contacts you wish to calculate=1452,2649 SWITCH64The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4793} WEIGHT64A weight value for a given contact, by default is 1=0.00325733
   ATOMS65the atoms involved in each of the contacts you wish to calculate=1453,2650 SWITCH65The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4790} WEIGHT65A weight value for a given contact, by default is 1=0.00325733
   ATOMS66the atoms involved in each of the contacts you wish to calculate=1455,2652 SWITCH66The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4784} WEIGHT66A weight value for a given contact, by default is 1=0.00325733
   ATOMS67the atoms involved in each of the contacts you wish to calculate=1462,2659 SWITCH67The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4828} WEIGHT67A weight value for a given contact, by default is 1=0.00325733
   ATOMS68the atoms involved in each of the contacts you wish to calculate=1463,2660 SWITCH68The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4874} WEIGHT68A weight value for a given contact, by default is 1=0.00325733
   ATOMS69the atoms involved in each of the contacts you wish to calculate=1464,2661 SWITCH69The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4853} WEIGHT69A weight value for a given contact, by default is 1=0.00325733
   ATOMS70the atoms involved in each of the contacts you wish to calculate=1466,2663 SWITCH70The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4862} WEIGHT70A weight value for a given contact, by default is 1=0.00325733
   ATOMS71the atoms involved in each of the contacts you wish to calculate=1484,2681 SWITCH71The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4773} WEIGHT71A weight value for a given contact, by default is 1=0.00325733
   ATOMS72the atoms involved in each of the contacts you wish to calculate=1485,2682 SWITCH72The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4791} WEIGHT72A weight value for a given contact, by default is 1=0.00325733
   ATOMS73the atoms involved in each of the contacts you wish to calculate=1486,2683 SWITCH73The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4668} WEIGHT73A weight value for a given contact, by default is 1=0.00325733
   ATOMS74the atoms involved in each of the contacts you wish to calculate=1488,2685 SWITCH74The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4558} WEIGHT74A weight value for a given contact, by default is 1=0.00325733
   ATOMS75the atoms involved in each of the contacts you wish to calculate=1495,2692 SWITCH75The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4439} WEIGHT75A weight value for a given contact, by default is 1=0.00325733
   ATOMS76the atoms involved in each of the contacts you wish to calculate=1496,2693 SWITCH76The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4367} WEIGHT76A weight value for a given contact, by default is 1=0.00325733
   ATOMS77the atoms involved in each of the contacts you wish to calculate=1497,2694 SWITCH77The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4434} WEIGHT77A weight value for a given contact, by default is 1=0.00325733
   ATOMS78the atoms involved in each of the contacts you wish to calculate=1499,2696 SWITCH78The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4389} WEIGHT78A weight value for a given contact, by default is 1=0.00325733
   ATOMS79the atoms involved in each of the contacts you wish to calculate=1502,2699 SWITCH79The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4465} WEIGHT79A weight value for a given contact, by default is 1=0.00325733
   ATOMS80the atoms involved in each of the contacts you wish to calculate=1503,2700 SWITCH80The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4493} WEIGHT80A weight value for a given contact, by default is 1=0.00325733
   ATOMS81the atoms involved in each of the contacts you wish to calculate=1504,2701 SWITCH81The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4454} WEIGHT81A weight value for a given contact, by default is 1=0.00325733
   ATOMS82the atoms involved in each of the contacts you wish to calculate=1506,2703 SWITCH82The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4586} WEIGHT82A weight value for a given contact, by default is 1=0.00325733
   ATOMS83the atoms involved in each of the contacts you wish to calculate=1513,2710 SWITCH83The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4830} WEIGHT83A weight value for a given contact, by default is 1=0.00325733
   ATOMS84the atoms involved in each of the contacts you wish to calculate=1514,2711 SWITCH84The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4893} WEIGHT84A weight value for a given contact, by default is 1=0.00325733
   ATOMS85the atoms involved in each of the contacts you wish to calculate=1515,2712 SWITCH85The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5015} WEIGHT85A weight value for a given contact, by default is 1=0.00325733
   ATOMS86the atoms involved in each of the contacts you wish to calculate=1517,2714 SWITCH86The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5305} WEIGHT86A weight value for a given contact, by default is 1=0.00325733
   ATOMS87the atoms involved in each of the contacts you wish to calculate=1532,2729 SWITCH87The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5028} WEIGHT87A weight value for a given contact, by default is 1=0.00325733
   ATOMS88the atoms involved in each of the contacts you wish to calculate=1533,2730 SWITCH88The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4855} WEIGHT88A weight value for a given contact, by default is 1=0.00325733
   ATOMS89the atoms involved in each of the contacts you wish to calculate=1534,2731 SWITCH89The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5088} WEIGHT89A weight value for a given contact, by default is 1=0.00325733
   ATOMS90the atoms involved in each of the contacts you wish to calculate=1536,2733 SWITCH90The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4846} WEIGHT90A weight value for a given contact, by default is 1=0.00325733
   ATOMS91the atoms involved in each of the contacts you wish to calculate=1539,2736 SWITCH91The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4677} WEIGHT91A weight value for a given contact, by default is 1=0.00325733
   ATOMS92the atoms involved in each of the contacts you wish to calculate=1540,2737 SWITCH92The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4686} WEIGHT92A weight value for a given contact, by default is 1=0.00325733
   ATOMS93the atoms involved in each of the contacts you wish to calculate=1541,2738 SWITCH93The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4618} WEIGHT93A weight value for a given contact, by default is 1=0.00325733
   ATOMS94the atoms involved in each of the contacts you wish to calculate=1543,2740 SWITCH94The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4492} WEIGHT94A weight value for a given contact, by default is 1=0.00325733
   ATOMS95the atoms involved in each of the contacts you wish to calculate=1553,2750 SWITCH95The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4637} WEIGHT95A weight value for a given contact, by default is 1=0.00325733
   ATOMS96the atoms involved in each of the contacts you wish to calculate=1554,2751 SWITCH96The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4762} WEIGHT96A weight value for a given contact, by default is 1=0.00325733
   ATOMS97the atoms involved in each of the contacts you wish to calculate=1555,2752 SWITCH97The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4651} WEIGHT97A weight value for a given contact, by default is 1=0.00325733
   ATOMS98the atoms involved in each of the contacts you wish to calculate=1557,2754 SWITCH98The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4760} WEIGHT98A weight value for a given contact, by default is 1=0.00325733
   ATOMS99the atoms involved in each of the contacts you wish to calculate=1572,2769 SWITCH99The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4823} WEIGHT99A weight value for a given contact, by default is 1=0.00325733
   ATOMS100the atoms involved in each of the contacts you wish to calculate=1573,2770 SWITCH100The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4846} WEIGHT100A weight value for a given contact, by default is 1=0.00325733
   ATOMS101the atoms involved in each of the contacts you wish to calculate=1574,2771 SWITCH101The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4869} WEIGHT101A weight value for a given contact, by default is 1=0.00325733
   ATOMS102the atoms involved in each of the contacts you wish to calculate=1576,2773 SWITCH102The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4914} WEIGHT102A weight value for a given contact, by default is 1=0.00325733
   ATOMS103the atoms involved in each of the contacts you wish to calculate=1589,2786 SWITCH103The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4883} WEIGHT103A weight value for a given contact, by default is 1=0.00325733
   ATOMS104the atoms involved in each of the contacts you wish to calculate=1590,2787 SWITCH104The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4896} WEIGHT104A weight value for a given contact, by default is 1=0.00325733
   ATOMS105the atoms involved in each of the contacts you wish to calculate=1591,2788 SWITCH105The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4859} WEIGHT105A weight value for a given contact, by default is 1=0.00325733
   ATOMS106the atoms involved in each of the contacts you wish to calculate=1593,2790 SWITCH106The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4825} WEIGHT106A weight value for a given contact, by default is 1=0.00325733
   ATOMS107the atoms involved in each of the contacts you wish to calculate=1606,2803 SWITCH107The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4929} WEIGHT107A weight value for a given contact, by default is 1=0.00325733
   ATOMS108the atoms involved in each of the contacts you wish to calculate=1607,2804 SWITCH108The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4950} WEIGHT108A weight value for a given contact, by default is 1=0.00325733
   ATOMS109the atoms involved in each of the contacts you wish to calculate=1608,2805 SWITCH109The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5002} WEIGHT109A weight value for a given contact, by default is 1=0.00325733
   ATOMS110the atoms involved in each of the contacts you wish to calculate=1610,2807 SWITCH110The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5156} WEIGHT110A weight value for a given contact, by default is 1=0.00325733
   ATOMS111the atoms involved in each of the contacts you wish to calculate=1628,2825 SWITCH111The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5122} WEIGHT111A weight value for a given contact, by default is 1=0.00325733
   ATOMS112the atoms involved in each of the contacts you wish to calculate=1629,2826 SWITCH112The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5071} WEIGHT112A weight value for a given contact, by default is 1=0.00325733
   ATOMS113the atoms involved in each of the contacts you wish to calculate=1630,2827 SWITCH113The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5180} WEIGHT113A weight value for a given contact, by default is 1=0.00325733
   ATOMS114the atoms involved in each of the contacts you wish to calculate=1634,2831 SWITCH114The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5085} WEIGHT114A weight value for a given contact, by default is 1=0.00325733
   ATOMS115the atoms involved in each of the contacts you wish to calculate=1642,2839 SWITCH115The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4979} WEIGHT115A weight value for a given contact, by default is 1=0.00325733
   ATOMS116the atoms involved in each of the contacts you wish to calculate=1643,2840 SWITCH116The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4962} WEIGHT116A weight value for a given contact, by default is 1=0.00325733
   ATOMS117the atoms involved in each of the contacts you wish to calculate=1644,2841 SWITCH117The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4922} WEIGHT117A weight value for a given contact, by default is 1=0.00325733
   ATOMS118the atoms involved in each of the contacts you wish to calculate=1646,2843 SWITCH118The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4858} WEIGHT118A weight value for a given contact, by default is 1=0.00325733
   ATOMS119the atoms involved in each of the contacts you wish to calculate=1649,2846 SWITCH119The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5302} WEIGHT119A weight value for a given contact, by default is 1=0.00325733
   ATOMS120the atoms involved in each of the contacts you wish to calculate=1650,2847 SWITCH120The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5979} WEIGHT120A weight value for a given contact, by default is 1=0.00325733
   ATOMS121the atoms involved in each of the contacts you wish to calculate=1651,2848 SWITCH121The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5101} WEIGHT121A weight value for a given contact, by default is 1=0.00325733
   ATOMS122the atoms involved in each of the contacts you wish to calculate=1653,2850 SWITCH122The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5612} WEIGHT122A weight value for a given contact, by default is 1=0.00325733
   ATOMS123the atoms involved in each of the contacts you wish to calculate=1656,2853 SWITCH123The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5585} WEIGHT123A weight value for a given contact, by default is 1=0.00325733
   ATOMS124the atoms involved in each of the contacts you wish to calculate=1657,2854 SWITCH124The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5981} WEIGHT124A weight value for a given contact, by default is 1=0.00325733
   ATOMS125the atoms involved in each of the contacts you wish to calculate=1658,2855 SWITCH125The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5193} WEIGHT125A weight value for a given contact, by default is 1=0.00325733
   ATOMS126the atoms involved in each of the contacts you wish to calculate=1660,2857 SWITCH126The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5023} WEIGHT126A weight value for a given contact, by default is 1=0.00325733
   ATOMS127the atoms involved in each of the contacts you wish to calculate=1663,2860 SWITCH127The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4841} WEIGHT127A weight value for a given contact, by default is 1=0.00325733
   ATOMS128the atoms involved in each of the contacts you wish to calculate=1664,2861 SWITCH128The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4786} WEIGHT128A weight value for a given contact, by default is 1=0.00325733
   ATOMS129the atoms involved in each of the contacts you wish to calculate=1665,2862 SWITCH129The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4803} WEIGHT129A weight value for a given contact, by default is 1=0.00325733
   ATOMS130the atoms involved in each of the contacts you wish to calculate=1667,2864 SWITCH130The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4748} WEIGHT130A weight value for a given contact, by default is 1=0.00325733
   ATOMS131the atoms involved in each of the contacts you wish to calculate=1680,2877 SWITCH131The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4724} WEIGHT131A weight value for a given contact, by default is 1=0.00325733
   ATOMS132the atoms involved in each of the contacts you wish to calculate=1681,2878 SWITCH132The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4738} WEIGHT132A weight value for a given contact, by default is 1=0.00325733
   ATOMS133the atoms involved in each of the contacts you wish to calculate=1682,2879 SWITCH133The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4717} WEIGHT133A weight value for a given contact, by default is 1=0.00325733
   ATOMS134the atoms involved in each of the contacts you wish to calculate=1684,2881 SWITCH134The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4663} WEIGHT134A weight value for a given contact, by default is 1=0.00325733
   ATOMS135the atoms involved in each of the contacts you wish to calculate=1696,2893 SWITCH135The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4872} WEIGHT135A weight value for a given contact, by default is 1=0.00325733
   ATOMS136the atoms involved in each of the contacts you wish to calculate=1697,2894 SWITCH136The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4923} WEIGHT136A weight value for a given contact, by default is 1=0.00325733
   ATOMS137the atoms involved in each of the contacts you wish to calculate=1698,2895 SWITCH137The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4984} WEIGHT137A weight value for a given contact, by default is 1=0.00325733
   ATOMS138the atoms involved in each of the contacts you wish to calculate=1700,2897 SWITCH138The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5199} WEIGHT138A weight value for a given contact, by default is 1=0.00325733
   ATOMS139the atoms involved in each of the contacts you wish to calculate=1711,2908 SWITCH139The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4997} WEIGHT139A weight value for a given contact, by default is 1=0.00325733
   ATOMS140the atoms involved in each of the contacts you wish to calculate=1712,2909 SWITCH140The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4951} WEIGHT140A weight value for a given contact, by default is 1=0.00325733
   ATOMS141the atoms involved in each of the contacts you wish to calculate=1713,2910 SWITCH141The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4897} WEIGHT141A weight value for a given contact, by default is 1=0.00325733
   ATOMS142the atoms involved in each of the contacts you wish to calculate=1715,2912 SWITCH142The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4782} WEIGHT142A weight value for a given contact, by default is 1=0.00325733
   ATOMS143the atoms involved in each of the contacts you wish to calculate=1727,2924 SWITCH143The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4806} WEIGHT143A weight value for a given contact, by default is 1=0.00325733
   ATOMS144the atoms involved in each of the contacts you wish to calculate=1728,2925 SWITCH144The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4799} WEIGHT144A weight value for a given contact, by default is 1=0.00325733
   ATOMS145the atoms involved in each of the contacts you wish to calculate=1729,2926 SWITCH145The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4839} WEIGHT145A weight value for a given contact, by default is 1=0.00325733
   ATOMS146the atoms involved in each of the contacts you wish to calculate=1731,2928 SWITCH146The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4841} WEIGHT146A weight value for a given contact, by default is 1=0.00325733
   ATOMS147the atoms involved in each of the contacts you wish to calculate=1749,2946 SWITCH147The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4833} WEIGHT147A weight value for a given contact, by default is 1=0.00325733
   ATOMS148the atoms involved in each of the contacts you wish to calculate=1750,2947 SWITCH148The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4831} WEIGHT148A weight value for a given contact, by default is 1=0.00325733
   ATOMS149the atoms involved in each of the contacts you wish to calculate=1751,2948 SWITCH149The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4804} WEIGHT149A weight value for a given contact, by default is 1=0.00325733
   ATOMS150the atoms involved in each of the contacts you wish to calculate=1753,2950 SWITCH150The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4713} WEIGHT150A weight value for a given contact, by default is 1=0.00325733
   ATOMS151the atoms involved in each of the contacts you wish to calculate=1760,2957 SWITCH151The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4889} WEIGHT151A weight value for a given contact, by default is 1=0.00325733
   ATOMS152the atoms involved in each of the contacts you wish to calculate=1761,2958 SWITCH152The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5034} WEIGHT152A weight value for a given contact, by default is 1=0.00325733
   ATOMS153the atoms involved in each of the contacts you wish to calculate=1762,2959 SWITCH153The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4875} WEIGHT153A weight value for a given contact, by default is 1=0.00325733
   ATOMS154the atoms involved in each of the contacts you wish to calculate=1764,2961 SWITCH154The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4884} WEIGHT154A weight value for a given contact, by default is 1=0.00325733
   ATOMS155the atoms involved in each of the contacts you wish to calculate=1775,2972 SWITCH155The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4862} WEIGHT155A weight value for a given contact, by default is 1=0.00325733
   ATOMS156the atoms involved in each of the contacts you wish to calculate=1776,2973 SWITCH156The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4858} WEIGHT156A weight value for a given contact, by default is 1=0.00325733
   ATOMS157the atoms involved in each of the contacts you wish to calculate=1777,2974 SWITCH157The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4828} WEIGHT157A weight value for a given contact, by default is 1=0.00325733
   ATOMS158the atoms involved in each of the contacts you wish to calculate=1779,2976 SWITCH158The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4779} WEIGHT158A weight value for a given contact, by default is 1=0.00325733
   ATOMS159the atoms involved in each of the contacts you wish to calculate=1797,2994 SWITCH159The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4837} WEIGHT159A weight value for a given contact, by default is 1=0.00325733
   ATOMS160the atoms involved in each of the contacts you wish to calculate=1798,2995 SWITCH160The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4841} WEIGHT160A weight value for a given contact, by default is 1=0.00325733
   ATOMS161the atoms involved in each of the contacts you wish to calculate=1799,2996 SWITCH161The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4859} WEIGHT161A weight value for a given contact, by default is 1=0.00325733
   ATOMS162the atoms involved in each of the contacts you wish to calculate=1801,2998 SWITCH162The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4884} WEIGHT162A weight value for a given contact, by default is 1=0.00325733
   ATOMS163the atoms involved in each of the contacts you wish to calculate=1816,3013 SWITCH163The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4921} WEIGHT163A weight value for a given contact, by default is 1=0.00325733
   ATOMS164the atoms involved in each of the contacts you wish to calculate=1817,3014 SWITCH164The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4952} WEIGHT164A weight value for a given contact, by default is 1=0.00325733
   ATOMS165the atoms involved in each of the contacts you wish to calculate=1818,3015 SWITCH165The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4950} WEIGHT165A weight value for a given contact, by default is 1=0.00325733
   ATOMS166the atoms involved in each of the contacts you wish to calculate=1820,3017 SWITCH166The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5045} WEIGHT166A weight value for a given contact, by default is 1=0.00325733
   ATOMS167the atoms involved in each of the contacts you wish to calculate=1828,3025 SWITCH167The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4919} WEIGHT167A weight value for a given contact, by default is 1=0.00325733
   ATOMS168the atoms involved in each of the contacts you wish to calculate=1829,3026 SWITCH168The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4916} WEIGHT168A weight value for a given contact, by default is 1=0.00325733
   ATOMS169the atoms involved in each of the contacts you wish to calculate=1830,3027 SWITCH169The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4850} WEIGHT169A weight value for a given contact, by default is 1=0.00325733
   ATOMS170the atoms involved in each of the contacts you wish to calculate=1832,3029 SWITCH170The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4818} WEIGHT170A weight value for a given contact, by default is 1=0.00325733
   ATOMS171the atoms involved in each of the contacts you wish to calculate=1848,3045 SWITCH171The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4789} WEIGHT171A weight value for a given contact, by default is 1=0.00325733
   ATOMS172the atoms involved in each of the contacts you wish to calculate=1849,3046 SWITCH172The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4780} WEIGHT172A weight value for a given contact, by default is 1=0.00325733
   ATOMS173the atoms involved in each of the contacts you wish to calculate=1850,3047 SWITCH173The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4760} WEIGHT173A weight value for a given contact, by default is 1=0.00325733
   ATOMS174the atoms involved in each of the contacts you wish to calculate=1852,3049 SWITCH174The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4724} WEIGHT174A weight value for a given contact, by default is 1=0.00325733
   ATOMS175the atoms involved in each of the contacts you wish to calculate=1870,3067 SWITCH175The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4784} WEIGHT175A weight value for a given contact, by default is 1=0.00325733
   ATOMS176the atoms involved in each of the contacts you wish to calculate=1871,3068 SWITCH176The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4799} WEIGHT176A weight value for a given contact, by default is 1=0.00325733
   ATOMS177the atoms involved in each of the contacts you wish to calculate=1872,3069 SWITCH177The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4830} WEIGHT177A weight value for a given contact, by default is 1=0.00325733
   ATOMS178the atoms involved in each of the contacts you wish to calculate=1874,3071 SWITCH178The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4908} WEIGHT178A weight value for a given contact, by default is 1=0.00325733
   ATOMS179the atoms involved in each of the contacts you wish to calculate=1882,3079 SWITCH179The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4806} WEIGHT179A weight value for a given contact, by default is 1=0.00325733
   ATOMS180the atoms involved in each of the contacts you wish to calculate=1883,3080 SWITCH180The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4854} WEIGHT180A weight value for a given contact, by default is 1=0.00325733
   ATOMS181the atoms involved in each of the contacts you wish to calculate=1884,3081 SWITCH181The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4681} WEIGHT181A weight value for a given contact, by default is 1=0.00325733
   ATOMS182the atoms involved in each of the contacts you wish to calculate=1886,3083 SWITCH182The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4562} WEIGHT182A weight value for a given contact, by default is 1=0.00325733
   ATOMS183the atoms involved in each of the contacts you wish to calculate=1906,3103 SWITCH183The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4499} WEIGHT183A weight value for a given contact, by default is 1=0.00325733
   ATOMS184the atoms involved in each of the contacts you wish to calculate=1907,3104 SWITCH184The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4412} WEIGHT184A weight value for a given contact, by default is 1=0.00325733
   ATOMS185the atoms involved in each of the contacts you wish to calculate=1908,3105 SWITCH185The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4540} WEIGHT185A weight value for a given contact, by default is 1=0.00325733
   ATOMS186the atoms involved in each of the contacts you wish to calculate=1910,3107 SWITCH186The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4641} WEIGHT186A weight value for a given contact, by default is 1=0.00325733
   ATOMS187the atoms involved in each of the contacts you wish to calculate=1922,3119 SWITCH187The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4737} WEIGHT187A weight value for a given contact, by default is 1=0.00325733
   ATOMS188the atoms involved in each of the contacts you wish to calculate=1923,3120 SWITCH188The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4756} WEIGHT188A weight value for a given contact, by default is 1=0.00325733
   ATOMS189the atoms involved in each of the contacts you wish to calculate=1924,3121 SWITCH189The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4813} WEIGHT189A weight value for a given contact, by default is 1=0.00325733
   ATOMS190the atoms involved in each of the contacts you wish to calculate=1926,3123 SWITCH190The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4903} WEIGHT190A weight value for a given contact, by default is 1=0.00325733
   ATOMS191the atoms involved in each of the contacts you wish to calculate=1939,3136 SWITCH191The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4888} WEIGHT191A weight value for a given contact, by default is 1=0.00325733
   ATOMS192the atoms involved in each of the contacts you wish to calculate=1940,3137 SWITCH192The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4907} WEIGHT192A weight value for a given contact, by default is 1=0.00325733
   ATOMS193the atoms involved in each of the contacts you wish to calculate=1941,3138 SWITCH193The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4854} WEIGHT193A weight value for a given contact, by default is 1=0.00325733
   ATOMS194the atoms involved in each of the contacts you wish to calculate=1943,3140 SWITCH194The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4812} WEIGHT194A weight value for a given contact, by default is 1=0.00325733
   ATOMS195the atoms involved in each of the contacts you wish to calculate=1950,3147 SWITCH195The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4815} WEIGHT195A weight value for a given contact, by default is 1=0.00325733
   ATOMS196the atoms involved in each of the contacts you wish to calculate=1951,3148 SWITCH196The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4820} WEIGHT196A weight value for a given contact, by default is 1=0.00325733
   ATOMS197the atoms involved in each of the contacts you wish to calculate=1952,3149 SWITCH197The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4825} WEIGHT197A weight value for a given contact, by default is 1=0.00325733
   ATOMS198the atoms involved in each of the contacts you wish to calculate=1954,3151 SWITCH198The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4840} WEIGHT198A weight value for a given contact, by default is 1=0.00325733
   ATOMS199the atoms involved in each of the contacts you wish to calculate=1972,3169 SWITCH199The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4806} WEIGHT199A weight value for a given contact, by default is 1=0.00325733
   ATOMS200the atoms involved in each of the contacts you wish to calculate=1973,3170 SWITCH200The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4799} WEIGHT200A weight value for a given contact, by default is 1=0.00325733
   ATOMS201the atoms involved in each of the contacts you wish to calculate=1974,3171 SWITCH201The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4784} WEIGHT201A weight value for a given contact, by default is 1=0.00325733
   ATOMS202the atoms involved in each of the contacts you wish to calculate=1976,3173 SWITCH202The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4718} WEIGHT202A weight value for a given contact, by default is 1=0.00325733
   ATOMS203the atoms involved in each of the contacts you wish to calculate=1991,3188 SWITCH203The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4803} WEIGHT203A weight value for a given contact, by default is 1=0.00325733
   ATOMS204the atoms involved in each of the contacts you wish to calculate=1992,3189 SWITCH204The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4813} WEIGHT204A weight value for a given contact, by default is 1=0.00325733
   ATOMS205the atoms involved in each of the contacts you wish to calculate=1993,3190 SWITCH205The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4871} WEIGHT205A weight value for a given contact, by default is 1=0.00325733
   ATOMS206the atoms involved in each of the contacts you wish to calculate=1995,3192 SWITCH206The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4958} WEIGHT206A weight value for a given contact, by default is 1=0.00325733
   ATOMS207the atoms involved in each of the contacts you wish to calculate=1998,3195 SWITCH207The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4910} WEIGHT207A weight value for a given contact, by default is 1=0.00325733
   ATOMS208the atoms involved in each of the contacts you wish to calculate=1999,3196 SWITCH208The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4912} WEIGHT208A weight value for a given contact, by default is 1=0.00325733
   ATOMS209the atoms involved in each of the contacts you wish to calculate=2000,3197 SWITCH209The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4885} WEIGHT209A weight value for a given contact, by default is 1=0.00325733
   ATOMS210the atoms involved in each of the contacts you wish to calculate=2002,3199 SWITCH210The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4856} WEIGHT210A weight value for a given contact, by default is 1=0.00325733
   ATOMS211the atoms involved in each of the contacts you wish to calculate=2009,3206 SWITCH211The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4908} WEIGHT211A weight value for a given contact, by default is 1=0.00325733
   ATOMS212the atoms involved in each of the contacts you wish to calculate=2010,3207 SWITCH212The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4917} WEIGHT212A weight value for a given contact, by default is 1=0.00325733
   ATOMS213the atoms involved in each of the contacts you wish to calculate=2011,3208 SWITCH213The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4956} WEIGHT213A weight value for a given contact, by default is 1=0.00325733
   ATOMS214the atoms involved in each of the contacts you wish to calculate=2013,3210 SWITCH214The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5041} WEIGHT214A weight value for a given contact, by default is 1=0.00325733
   ATOMS215the atoms involved in each of the contacts you wish to calculate=2028,3225 SWITCH215The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4965} WEIGHT215A weight value for a given contact, by default is 1=0.00325733
   ATOMS216the atoms involved in each of the contacts you wish to calculate=2029,3226 SWITCH216The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4843} WEIGHT216A weight value for a given contact, by default is 1=0.00325733
   ATOMS217the atoms involved in each of the contacts you wish to calculate=2030,3227 SWITCH217The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5022} WEIGHT217A weight value for a given contact, by default is 1=0.00325733
   ATOMS218the atoms involved in each of the contacts you wish to calculate=2032,3229 SWITCH218The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4902} WEIGHT218A weight value for a given contact, by default is 1=0.00325733
   ATOMS219the atoms involved in each of the contacts you wish to calculate=2040,3237 SWITCH219The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4835} WEIGHT219A weight value for a given contact, by default is 1=0.00325733
   ATOMS220the atoms involved in each of the contacts you wish to calculate=2041,3238 SWITCH220The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4778} WEIGHT220A weight value for a given contact, by default is 1=0.00325733
   ATOMS221the atoms involved in each of the contacts you wish to calculate=2042,3239 SWITCH221The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4834} WEIGHT221A weight value for a given contact, by default is 1=0.00325733
   ATOMS222the atoms involved in each of the contacts you wish to calculate=2044,3241 SWITCH222The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4824} WEIGHT222A weight value for a given contact, by default is 1=0.00325733
   ATOMS223the atoms involved in each of the contacts you wish to calculate=2054,3251 SWITCH223The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4822} WEIGHT223A weight value for a given contact, by default is 1=0.00325733
   ATOMS224the atoms involved in each of the contacts you wish to calculate=2055,3252 SWITCH224The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4821} WEIGHT224A weight value for a given contact, by default is 1=0.00325733
   ATOMS225the atoms involved in each of the contacts you wish to calculate=2056,3253 SWITCH225The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4826} WEIGHT225A weight value for a given contact, by default is 1=0.00325733
   ATOMS226the atoms involved in each of the contacts you wish to calculate=2058,3255 SWITCH226The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4798} WEIGHT226A weight value for a given contact, by default is 1=0.00325733
   ATOMS227the atoms involved in each of the contacts you wish to calculate=2073,3270 SWITCH227The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4794} WEIGHT227A weight value for a given contact, by default is 1=0.00325733
   ATOMS228the atoms involved in each of the contacts you wish to calculate=2074,3271 SWITCH228The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4799} WEIGHT228A weight value for a given contact, by default is 1=0.00325733
   ATOMS229the atoms involved in each of the contacts you wish to calculate=2075,3272 SWITCH229The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4766} WEIGHT229A weight value for a given contact, by default is 1=0.00325733
   ATOMS230the atoms involved in each of the contacts you wish to calculate=2077,3274 SWITCH230The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4707} WEIGHT230A weight value for a given contact, by default is 1=0.00325733
   ATOMS231the atoms involved in each of the contacts you wish to calculate=2087,3284 SWITCH231The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4824} WEIGHT231A weight value for a given contact, by default is 1=0.00325733
   ATOMS232the atoms involved in each of the contacts you wish to calculate=2088,3285 SWITCH232The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4839} WEIGHT232A weight value for a given contact, by default is 1=0.00325733
   ATOMS233the atoms involved in each of the contacts you wish to calculate=2089,3286 SWITCH233The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4900} WEIGHT233A weight value for a given contact, by default is 1=0.00325733
   ATOMS234the atoms involved in each of the contacts you wish to calculate=2091,3288 SWITCH234The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4990} WEIGHT234A weight value for a given contact, by default is 1=0.00325733
   ATOMS235the atoms involved in each of the contacts you wish to calculate=2104,3301 SWITCH235The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4896} WEIGHT235A weight value for a given contact, by default is 1=0.00325733
   ATOMS236the atoms involved in each of the contacts you wish to calculate=2105,3302 SWITCH236The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4899} WEIGHT236A weight value for a given contact, by default is 1=0.00325733
   ATOMS237the atoms involved in each of the contacts you wish to calculate=2106,3303 SWITCH237The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4814} WEIGHT237A weight value for a given contact, by default is 1=0.00325733
   ATOMS238the atoms involved in each of the contacts you wish to calculate=2108,3305 SWITCH238The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4709} WEIGHT238A weight value for a given contact, by default is 1=0.00325733
   ATOMS239the atoms involved in each of the contacts you wish to calculate=2120,3317 SWITCH239The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4687} WEIGHT239A weight value for a given contact, by default is 1=0.00325733
   ATOMS240the atoms involved in each of the contacts you wish to calculate=2121,3318 SWITCH240The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4706} WEIGHT240A weight value for a given contact, by default is 1=0.00325733
   ATOMS241the atoms involved in each of the contacts you wish to calculate=2122,3319 SWITCH241The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4610} WEIGHT241A weight value for a given contact, by default is 1=0.00325733
   ATOMS242the atoms involved in each of the contacts you wish to calculate=2126,3323 SWITCH242The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4767} WEIGHT242A weight value for a given contact, by default is 1=0.00325733
   ATOMS243the atoms involved in each of the contacts you wish to calculate=2134,3331 SWITCH243The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4626} WEIGHT243A weight value for a given contact, by default is 1=0.00325733
   ATOMS244the atoms involved in each of the contacts you wish to calculate=2135,3332 SWITCH244The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4945} WEIGHT244A weight value for a given contact, by default is 1=0.00325733
   ATOMS245the atoms involved in each of the contacts you wish to calculate=2136,3333 SWITCH245The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4301} WEIGHT245A weight value for a given contact, by default is 1=0.00325733
   ATOMS246the atoms involved in each of the contacts you wish to calculate=2138,3335 SWITCH246The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4297} WEIGHT246A weight value for a given contact, by default is 1=0.00325733
   ATOMS247the atoms involved in each of the contacts you wish to calculate=2141,3338 SWITCH247The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4816} WEIGHT247A weight value for a given contact, by default is 1=0.00325733
   ATOMS248the atoms involved in each of the contacts you wish to calculate=2142,3339 SWITCH248The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5264} WEIGHT248A weight value for a given contact, by default is 1=0.00325733
   ATOMS249the atoms involved in each of the contacts you wish to calculate=2143,3340 SWITCH249The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4917} WEIGHT249A weight value for a given contact, by default is 1=0.00325733
   ATOMS250the atoms involved in each of the contacts you wish to calculate=2145,3342 SWITCH250The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5309} WEIGHT250A weight value for a given contact, by default is 1=0.00325733
   ATOMS251the atoms involved in each of the contacts you wish to calculate=2148,3345 SWITCH251The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5306} WEIGHT251A weight value for a given contact, by default is 1=0.00325733
   ATOMS252the atoms involved in each of the contacts you wish to calculate=2149,3346 SWITCH252The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5084} WEIGHT252A weight value for a given contact, by default is 1=0.00325733
   ATOMS253the atoms involved in each of the contacts you wish to calculate=2150,3347 SWITCH253The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5824} WEIGHT253A weight value for a given contact, by default is 1=0.00325733
   ATOMS254the atoms involved in each of the contacts you wish to calculate=2152,3349 SWITCH254The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.6021} WEIGHT254A weight value for a given contact, by default is 1=0.00325733
   ATOMS255the atoms involved in each of the contacts you wish to calculate=2155,3352 SWITCH255The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5432} WEIGHT255A weight value for a given contact, by default is 1=0.00325733
   ATOMS256the atoms involved in each of the contacts you wish to calculate=2156,3353 SWITCH256The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5281} WEIGHT256A weight value for a given contact, by default is 1=0.00325733
   ATOMS257the atoms involved in each of the contacts you wish to calculate=2157,3354 SWITCH257The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5169} WEIGHT257A weight value for a given contact, by default is 1=0.00325733
   ATOMS258the atoms involved in each of the contacts you wish to calculate=2159,3356 SWITCH258The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4854} WEIGHT258A weight value for a given contact, by default is 1=0.00325733
   ATOMS259the atoms involved in each of the contacts you wish to calculate=2169,3366 SWITCH259The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4847} WEIGHT259A weight value for a given contact, by default is 1=0.00325733
   ATOMS260the atoms involved in each of the contacts you wish to calculate=2170,3367 SWITCH260The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4839} WEIGHT260A weight value for a given contact, by default is 1=0.00325733
   ATOMS261the atoms involved in each of the contacts you wish to calculate=2171,3368 SWITCH261The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4903} WEIGHT261A weight value for a given contact, by default is 1=0.00325733
   ATOMS262the atoms involved in each of the contacts you wish to calculate=2173,3370 SWITCH262The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5038} WEIGHT262A weight value for a given contact, by default is 1=0.00325733
   ATOMS263the atoms involved in each of the contacts you wish to calculate=2191,3388 SWITCH263The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4857} WEIGHT263A weight value for a given contact, by default is 1=0.00325733
   ATOMS264the atoms involved in each of the contacts you wish to calculate=2192,3389 SWITCH264The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4836} WEIGHT264A weight value for a given contact, by default is 1=0.00325733
   ATOMS265the atoms involved in each of the contacts you wish to calculate=2193,3390 SWITCH265The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4767} WEIGHT265A weight value for a given contact, by default is 1=0.00325733
   ATOMS266the atoms involved in each of the contacts you wish to calculate=2195,3392 SWITCH266The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4801} WEIGHT266A weight value for a given contact, by default is 1=0.00325733
   ATOMS267the atoms involved in each of the contacts you wish to calculate=2213,3410 SWITCH267The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4805} WEIGHT267A weight value for a given contact, by default is 1=0.00325733
   ATOMS268the atoms involved in each of the contacts you wish to calculate=2214,3411 SWITCH268The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4819} WEIGHT268A weight value for a given contact, by default is 1=0.00325733
   ATOMS269the atoms involved in each of the contacts you wish to calculate=2215,3412 SWITCH269The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4838} WEIGHT269A weight value for a given contact, by default is 1=0.00325733
   ATOMS270the atoms involved in each of the contacts you wish to calculate=2217,3414 SWITCH270The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4901} WEIGHT270A weight value for a given contact, by default is 1=0.00325733
   ATOMS271the atoms involved in each of the contacts you wish to calculate=2232,3429 SWITCH271The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4930} WEIGHT271A weight value for a given contact, by default is 1=0.00325733
   ATOMS272the atoms involved in each of the contacts you wish to calculate=2233,3430 SWITCH272The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4933} WEIGHT272A weight value for a given contact, by default is 1=0.00325733
   ATOMS273the atoms involved in each of the contacts you wish to calculate=2234,3431 SWITCH273The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4952} WEIGHT273A weight value for a given contact, by default is 1=0.00325733
   ATOMS274the atoms involved in each of the contacts you wish to calculate=2236,3433 SWITCH274The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4978} WEIGHT274A weight value for a given contact, by default is 1=0.00325733
   ATOMS275the atoms involved in each of the contacts you wish to calculate=2247,3444 SWITCH275The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4875} WEIGHT275A weight value for a given contact, by default is 1=0.00325733
   ATOMS276the atoms involved in each of the contacts you wish to calculate=2248,3445 SWITCH276The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4868} WEIGHT276A weight value for a given contact, by default is 1=0.00325733
   ATOMS277the atoms involved in each of the contacts you wish to calculate=2249,3446 SWITCH277The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4792} WEIGHT277A weight value for a given contact, by default is 1=0.00325733
   ATOMS278the atoms involved in each of the contacts you wish to calculate=2251,3448 SWITCH278The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4722} WEIGHT278A weight value for a given contact, by default is 1=0.00325733
   ATOMS279the atoms involved in each of the contacts you wish to calculate=2261,3458 SWITCH279The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4768} WEIGHT279A weight value for a given contact, by default is 1=0.00325733
   ATOMS280the atoms involved in each of the contacts you wish to calculate=2262,3459 SWITCH280The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4814} WEIGHT280A weight value for a given contact, by default is 1=0.00325733
   ATOMS281the atoms involved in each of the contacts you wish to calculate=2263,3460 SWITCH281The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4795} WEIGHT281A weight value for a given contact, by default is 1=0.00325733
   ATOMS282the atoms involved in each of the contacts you wish to calculate=2265,3462 SWITCH282The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4934} WEIGHT282A weight value for a given contact, by default is 1=0.00325733
   ATOMS283the atoms involved in each of the contacts you wish to calculate=2278,3475 SWITCH283The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4869} WEIGHT283A weight value for a given contact, by default is 1=0.00325733
   ATOMS284the atoms involved in each of the contacts you wish to calculate=2279,3476 SWITCH284The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4849} WEIGHT284A weight value for a given contact, by default is 1=0.00325733
   ATOMS285the atoms involved in each of the contacts you wish to calculate=2280,3477 SWITCH285The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4874} WEIGHT285A weight value for a given contact, by default is 1=0.00325733
   ATOMS286the atoms involved in each of the contacts you wish to calculate=2282,3479 SWITCH286The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4927} WEIGHT286A weight value for a given contact, by default is 1=0.00325733
   ATOMS287the atoms involved in each of the contacts you wish to calculate=2300,3497 SWITCH287The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4902} WEIGHT287A weight value for a given contact, by default is 1=0.00325733
   ATOMS288the atoms involved in each of the contacts you wish to calculate=2301,3498 SWITCH288The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4907} WEIGHT288A weight value for a given contact, by default is 1=0.00325733
   ATOMS289the atoms involved in each of the contacts you wish to calculate=2302,3499 SWITCH289The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4885} WEIGHT289A weight value for a given contact, by default is 1=0.00325733
   ATOMS290the atoms involved in each of the contacts you wish to calculate=2304,3501 SWITCH290The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4915} WEIGHT290A weight value for a given contact, by default is 1=0.00325733
   ATOMS291the atoms involved in each of the contacts you wish to calculate=2319,3516 SWITCH291The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4869} WEIGHT291A weight value for a given contact, by default is 1=0.00325733
   ATOMS292the atoms involved in each of the contacts you wish to calculate=2320,3517 SWITCH292The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4854} WEIGHT292A weight value for a given contact, by default is 1=0.00325733
   ATOMS293the atoms involved in each of the contacts you wish to calculate=2321,3518 SWITCH293The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4863} WEIGHT293A weight value for a given contact, by default is 1=0.00325733
   ATOMS294the atoms involved in each of the contacts you wish to calculate=2323,3520 SWITCH294The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4890} WEIGHT294A weight value for a given contact, by default is 1=0.00325733
   ATOMS295the atoms involved in each of the contacts you wish to calculate=2333,3530 SWITCH295The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4849} WEIGHT295A weight value for a given contact, by default is 1=0.00325733
   ATOMS296the atoms involved in each of the contacts you wish to calculate=2334,3531 SWITCH296The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4845} WEIGHT296A weight value for a given contact, by default is 1=0.00325733
   ATOMS297the atoms involved in each of the contacts you wish to calculate=2335,3532 SWITCH297The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4841} WEIGHT297A weight value for a given contact, by default is 1=0.00325733
   ATOMS298the atoms involved in each of the contacts you wish to calculate=2337,3534 SWITCH298The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4834} WEIGHT298A weight value for a given contact, by default is 1=0.00325733
   ATOMS299the atoms involved in each of the contacts you wish to calculate=2353,3550 SWITCH299The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4889} WEIGHT299A weight value for a given contact, by default is 1=0.00325733
   ATOMS300the atoms involved in each of the contacts you wish to calculate=2354,3551 SWITCH300The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4898} WEIGHT300A weight value for a given contact, by default is 1=0.00325733
   ATOMS301the atoms involved in each of the contacts you wish to calculate=2355,3552 SWITCH301The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4898} WEIGHT301A weight value for a given contact, by default is 1=0.00325733
   ATOMS302the atoms involved in each of the contacts you wish to calculate=2357,3554 SWITCH302The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.4939} WEIGHT302A weight value for a given contact, by default is 1=0.00325733
   ATOMS303the atoms involved in each of the contacts you wish to calculate=2377,3574 SWITCH303The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5068} WEIGHT303A weight value for a given contact, by default is 1=0.00325733
   ATOMS304the atoms involved in each of the contacts you wish to calculate=2378,3575 SWITCH304The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5033} WEIGHT304A weight value for a given contact, by default is 1=0.00325733
   ATOMS305the atoms involved in each of the contacts you wish to calculate=2379,3576 SWITCH305The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5297} WEIGHT305A weight value for a given contact, by default is 1=0.00325733
   ATOMS306the atoms involved in each of the contacts you wish to calculate=2381,3578 SWITCH306The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.5738} WEIGHT306A weight value for a given contact, by default is 1=0.00325733
   ATOMS307the atoms involved in each of the contacts you wish to calculate=2392,3589 SWITCH307The switching functions to use for each of the contacts in your map. Options for this keyword are explained in the documentation for LESS_THAN.={RATIONAL R_0=0.2 D_0=0.6245} WEIGHT307A weight value for a given contact, by default is 1=0.00325733

   SUM calculate the sum of all the contacts in the input
...


The CONTACTMAP action with label cmapbc calculates the following quantities:
 Quantity   
 Description  
cmapbc.contact
By not using SUM or CMDIST each contact will be stored in a component
cmapbc.value
the sum of all the switching function on all the distancesrestrainta: RESTRAINTAdds harmonic and/or linear restraints on one or more variables. More details ARGthe values the harmonic restraint acts upon=cmapab KAPPA specifies that the restraint is harmonic and what the values of the force constants on each of the variables are=50000.0 ATthe position of the restraint=1.0
The RESTRAINT action with label restrainta calculates the following quantities:
 Quantity   
 Description  
restrainta.bias
the instantaneous value of the bias potential
restrainta.force2
the instantaneous value of the squared force due to this bias potentialrestraintb: RESTRAINTAdds harmonic and/or linear restraints on one or more variables. More details ARGthe values the harmonic restraint acts upon=cmapbc KAPPA specifies that the restraint is harmonic and what the values of the force constants on each of the variables are=50000.0 ATthe position of the restraint=1.0
#metad: METAD ARG=cmap PACE=1000 HEIGHT=2.577483412 SIGMA=0.0005 FILE=HILLS GRID_MIN=0.0 GRID_MAX=1.1 BIASFACTOR=3.0 TEMP=310.0 RESTART=YES
The RESTRAINT action with label restraintb calculates the following quantities:
 Quantity   
 Description  
restraintb.bias
the instantaneous value of the bias potential
restraintb.force2
the instantaneous value of the squared force due to this bias potentialmetad: METADUsed to performed metadynamics on one or more collective variables. More details ARGthe labels of the scalars on which the bias will act=sumrmsdint PACEthe frequency for hill addition=625 HEIGHTthe heights of the Gaussian hills=2.577483412 SIGMAthe widths of the Gaussian hills=0.05 FILE a file in which the list of added hills is stored=HILLS GRID_MINthe lower bounds for the grid=0.0 GRID_MAXthe upper bounds for the grid=17.0 BIASFACTORuse well tempered metadynamics and use this bias factor=2.0 TEMPthe system temperature - this is only needed if you are doing well-tempered metadynamics=310.0 RESTARTallows per-action setting of restart (YES/NO/AUTO)=YES

The METAD action with label metad calculates the following quantities:
 Quantity   
 Description  
metad.bias
the instantaneous value of the bias potentialPRINTPrint quantities to a file. More details ARGthe labels of the values that you would like to print to the file=rmsda,rmsdb,rmsdc,sumrmsdint,cmapab,cmapbc,restrainta.bias,restraintb.bias,metad.bias FILEthe name of the file on which to output these quantities=COLVAR STRIDE the frequency with which the quantities of interest should be output=625
FLUSHThis command instructs plumed to flush all the open files with a user specified frequency. More details STRIDEthe frequency with which all the open files should be flushed=500