PLUMED-NEST by plumed-nest

Project ID: plumID:26.008
Source: plumed_sod.dat
Originally used with PLUMED version: 2.10
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
UNITSThis command sets the internal units for the code. More details LENGTHthe units of lengths=A TIMEthe units of time=ps
The UNITS action with label  calculates somethingLOADLoads a library, possibly defining new actions. More details FILEfile to be loaded=../../plumed_so/PytorchModelBiasVerletBox.so

p1: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=1
The POSITION action with label p1 calculates the following quantities: Quantity    Description  
p1.x the x-component of the atom position
p1.y the y-component of the atom position
p1.z the z-component of the atom positionp2: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=2
The POSITION action with label p2 calculates the following quantities: Quantity    Description  
p2.x the x-component of the atom position
p2.y the y-component of the atom position
p2.z the z-component of the atom positionp3: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=3
The POSITION action with label p3 calculates the following quantities: Quantity    Description  
p3.x the x-component of the atom position
p3.y the y-component of the atom position
p3.z the z-component of the atom positionp4: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=4
The POSITION action with label p4 calculates the following quantities: Quantity    Description  
p4.x the x-component of the atom position
p4.y the y-component of the atom position
p4.z the z-component of the atom positionp5: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=5
The POSITION action with label p5 calculates the following quantities: Quantity    Description  
p5.x the x-component of the atom position
p5.y the y-component of the atom position
p5.z the z-component of the atom positionp6: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=6
The POSITION action with label p6 calculates the following quantities: Quantity    Description  
p6.x the x-component of the atom position
p6.y the y-component of the atom position
p6.z the z-component of the atom positionp7: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=7
The POSITION action with label p7 calculates the following quantities: Quantity    Description  
p7.x the x-component of the atom position
p7.y the y-component of the atom position
p7.z the z-component of the atom positionp8: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=8
The POSITION action with label p8 calculates the following quantities: Quantity    Description  
p8.x the x-component of the atom position
p8.y the y-component of the atom position
p8.z the z-component of the atom positionp9: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=9
The POSITION action with label p9 calculates the following quantities: Quantity    Description  
p9.x the x-component of the atom position
p9.y the y-component of the atom position
p9.z the z-component of the atom positionp10: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=10
The POSITION action with label p10 calculates the following quantities: Quantity    Description  
p10.x the x-component of the atom position
p10.y the y-component of the atom position
p10.z the z-component of the atom positionp11: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=11
The POSITION action with label p11 calculates the following quantities: Quantity    Description  
p11.x the x-component of the atom position
p11.y the y-component of the atom position
p11.z the z-component of the atom positionp12: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=12
The POSITION action with label p12 calculates the following quantities: Quantity    Description  
p12.x the x-component of the atom position
p12.y the y-component of the atom position
p12.z the z-component of the atom positionp13: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=13
The POSITION action with label p13 calculates the following quantities: Quantity    Description  
p13.x the x-component of the atom position
p13.y the y-component of the atom position
p13.z the z-component of the atom positionp14: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=14
The POSITION action with label p14 calculates the following quantities: Quantity    Description  
p14.x the x-component of the atom position
p14.y the y-component of the atom position
p14.z the z-component of the atom positionp15: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=15
The POSITION action with label p15 calculates the following quantities: Quantity    Description  
p15.x the x-component of the atom position
p15.y the y-component of the atom position
p15.z the z-component of the atom positionp16: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=16
The POSITION action with label p16 calculates the following quantities: Quantity    Description  
p16.x the x-component of the atom position
p16.y the y-component of the atom position
p16.z the z-component of the atom positionp17: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=17
The POSITION action with label p17 calculates the following quantities: Quantity    Description  
p17.x the x-component of the atom position
p17.y the y-component of the atom position
p17.z the z-component of the atom positionp18: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=18
The POSITION action with label p18 calculates the following quantities: Quantity    Description  
p18.x the x-component of the atom position
p18.y the y-component of the atom position
p18.z the z-component of the atom positionp19: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=19
The POSITION action with label p19 calculates the following quantities: Quantity    Description  
p19.x the x-component of the atom position
p19.y the y-component of the atom position
p19.z the z-component of the atom positionp20: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=20
The POSITION action with label p20 calculates the following quantities: Quantity    Description  
p20.x the x-component of the atom position
p20.y the y-component of the atom position
p20.z the z-component of the atom positionp21: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=21
The POSITION action with label p21 calculates the following quantities: Quantity    Description  
p21.x the x-component of the atom position
p21.y the y-component of the atom position
p21.z the z-component of the atom positionp22: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=22
The POSITION action with label p22 calculates the following quantities: Quantity    Description  
p22.x the x-component of the atom position
p22.y the y-component of the atom position
p22.z the z-component of the atom positionp23: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=23
The POSITION action with label p23 calculates the following quantities: Quantity    Description  
p23.x the x-component of the atom position
p23.y the y-component of the atom position
p23.z the z-component of the atom positionp24: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=24
The POSITION action with label p24 calculates the following quantities: Quantity    Description  
p24.x the x-component of the atom position
p24.y the y-component of the atom position
p24.z the z-component of the atom positionp25: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=25
The POSITION action with label p25 calculates the following quantities: Quantity    Description  
p25.x the x-component of the atom position
p25.y the y-component of the atom position
p25.z the z-component of the atom positionp26: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=26
The POSITION action with label p26 calculates the following quantities: Quantity    Description  
p26.x the x-component of the atom position
p26.y the y-component of the atom position
p26.z the z-component of the atom positionp27: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=27
The POSITION action with label p27 calculates the following quantities: Quantity    Description  
p27.x the x-component of the atom position
p27.y the y-component of the atom position
p27.z the z-component of the atom positionp28: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=28
The POSITION action with label p28 calculates the following quantities: Quantity    Description  
p28.x the x-component of the atom position
p28.y the y-component of the atom position
p28.z the z-component of the atom positionp29: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=29
The POSITION action with label p29 calculates the following quantities: Quantity    Description  
p29.x the x-component of the atom position
p29.y the y-component of the atom position
p29.z the z-component of the atom positionp30: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=30
The POSITION action with label p30 calculates the following quantities: Quantity    Description  
p30.x the x-component of the atom position
p30.y the y-component of the atom position
p30.z the z-component of the atom positionp31: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=31
The POSITION action with label p31 calculates the following quantities: Quantity    Description  
p31.x the x-component of the atom position
p31.y the y-component of the atom position
p31.z the z-component of the atom positionp32: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=32
The POSITION action with label p32 calculates the following quantities: Quantity    Description  
p32.x the x-component of the atom position
p32.y the y-component of the atom position
p32.z the z-component of the atom positionp33: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=33
The POSITION action with label p33 calculates the following quantities: Quantity    Description  
p33.x the x-component of the atom position
p33.y the y-component of the atom position
p33.z the z-component of the atom positionp34: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=34
The POSITION action with label p34 calculates the following quantities: Quantity    Description  
p34.x the x-component of the atom position
p34.y the y-component of the atom position
p34.z the z-component of the atom positionp35: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=35
The POSITION action with label p35 calculates the following quantities: Quantity    Description  
p35.x the x-component of the atom position
p35.y the y-component of the atom position
p35.z the z-component of the atom positionp36: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=36
The POSITION action with label p36 calculates the following quantities: Quantity    Description  
p36.x the x-component of the atom position
p36.y the y-component of the atom position
p36.z the z-component of the atom positionp37: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=37
The POSITION action with label p37 calculates the following quantities: Quantity    Description  
p37.x the x-component of the atom position
p37.y the y-component of the atom position
p37.z the z-component of the atom positionp38: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=38
The POSITION action with label p38 calculates the following quantities: Quantity    Description  
p38.x the x-component of the atom position
p38.y the y-component of the atom position
p38.z the z-component of the atom positionp39: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=39
The POSITION action with label p39 calculates the following quantities: Quantity    Description  
p39.x the x-component of the atom position
p39.y the y-component of the atom position
p39.z the z-component of the atom positionp40: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=40
The POSITION action with label p40 calculates the following quantities: Quantity    Description  
p40.x the x-component of the atom position
p40.y the y-component of the atom position
p40.z the z-component of the atom positionp41: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=41
The POSITION action with label p41 calculates the following quantities: Quantity    Description  
p41.x the x-component of the atom position
p41.y the y-component of the atom position
p41.z the z-component of the atom positionp42: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=42
The POSITION action with label p42 calculates the following quantities: Quantity    Description  
p42.x the x-component of the atom position
p42.y the y-component of the atom position
p42.z the z-component of the atom positionp43: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=43
The POSITION action with label p43 calculates the following quantities: Quantity    Description  
p43.x the x-component of the atom position
p43.y the y-component of the atom position
p43.z the z-component of the atom positionp44: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=44
The POSITION action with label p44 calculates the following quantities: Quantity    Description  
p44.x the x-component of the atom position
p44.y the y-component of the atom position
p44.z the z-component of the atom positionp45: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=45
The POSITION action with label p45 calculates the following quantities: Quantity    Description  
p45.x the x-component of the atom position
p45.y the y-component of the atom position
p45.z the z-component of the atom positionp46: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=46
The POSITION action with label p46 calculates the following quantities: Quantity    Description  
p46.x the x-component of the atom position
p46.y the y-component of the atom position
p46.z the z-component of the atom positionp47: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=47
The POSITION action with label p47 calculates the following quantities: Quantity    Description  
p47.x the x-component of the atom position
p47.y the y-component of the atom position
p47.z the z-component of the atom positionp48: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=48
The POSITION action with label p48 calculates the following quantities: Quantity    Description  
p48.x the x-component of the atom position
p48.y the y-component of the atom position
p48.z the z-component of the atom positionp49: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=49
The POSITION action with label p49 calculates the following quantities: Quantity    Description  
p49.x the x-component of the atom position
p49.y the y-component of the atom position
p49.z the z-component of the atom positionp50: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=50
The POSITION action with label p50 calculates the following quantities: Quantity    Description  
p50.x the x-component of the atom position
p50.y the y-component of the atom position
p50.z the z-component of the atom positionp51: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=51
The POSITION action with label p51 calculates the following quantities: Quantity    Description  
p51.x the x-component of the atom position
p51.y the y-component of the atom position
p51.z the z-component of the atom positionp52: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=52
The POSITION action with label p52 calculates the following quantities: Quantity    Description  
p52.x the x-component of the atom position
p52.y the y-component of the atom position
p52.z the z-component of the atom positionp53: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=53
The POSITION action with label p53 calculates the following quantities: Quantity    Description  
p53.x the x-component of the atom position
p53.y the y-component of the atom position
p53.z the z-component of the atom positionp54: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=54
The POSITION action with label p54 calculates the following quantities: Quantity    Description  
p54.x the x-component of the atom position
p54.y the y-component of the atom position
p54.z the z-component of the atom positionp55: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=55
The POSITION action with label p55 calculates the following quantities: Quantity    Description  
p55.x the x-component of the atom position
p55.y the y-component of the atom position
p55.z the z-component of the atom positionp56: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=56
The POSITION action with label p56 calculates the following quantities: Quantity    Description  
p56.x the x-component of the atom position
p56.y the y-component of the atom position
p56.z the z-component of the atom positionp57: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=57
The POSITION action with label p57 calculates the following quantities: Quantity    Description  
p57.x the x-component of the atom position
p57.y the y-component of the atom position
p57.z the z-component of the atom positionp58: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=58
The POSITION action with label p58 calculates the following quantities: Quantity    Description  
p58.x the x-component of the atom position
p58.y the y-component of the atom position
p58.z the z-component of the atom positionp59: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=59
The POSITION action with label p59 calculates the following quantities: Quantity    Description  
p59.x the x-component of the atom position
p59.y the y-component of the atom position
p59.z the z-component of the atom positionp60: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=60
The POSITION action with label p60 calculates the following quantities: Quantity    Description  
p60.x the x-component of the atom position
p60.y the y-component of the atom position
p60.z the z-component of the atom positionp61: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=61
The POSITION action with label p61 calculates the following quantities: Quantity    Description  
p61.x the x-component of the atom position
p61.y the y-component of the atom position
p61.z the z-component of the atom positionp62: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=62
The POSITION action with label p62 calculates the following quantities: Quantity    Description  
p62.x the x-component of the atom position
p62.y the y-component of the atom position
p62.z the z-component of the atom positionp63: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=63
The POSITION action with label p63 calculates the following quantities: Quantity    Description  
p63.x the x-component of the atom position
p63.y the y-component of the atom position
p63.z the z-component of the atom positionp64: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=64
The POSITION action with label p64 calculates the following quantities: Quantity    Description  
p64.x the x-component of the atom position
p64.y the y-component of the atom position
p64.z the z-component of the atom positionp65: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=65
The POSITION action with label p65 calculates the following quantities: Quantity    Description  
p65.x the x-component of the atom position
p65.y the y-component of the atom position
p65.z the z-component of the atom positionp66: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=66
The POSITION action with label p66 calculates the following quantities: Quantity    Description  
p66.x the x-component of the atom position
p66.y the y-component of the atom position
p66.z the z-component of the atom positionp67: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=67
The POSITION action with label p67 calculates the following quantities: Quantity    Description  
p67.x the x-component of the atom position
p67.y the y-component of the atom position
p67.z the z-component of the atom positionp68: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=68
The POSITION action with label p68 calculates the following quantities: Quantity    Description  
p68.x the x-component of the atom position
p68.y the y-component of the atom position
p68.z the z-component of the atom positionp69: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=69
The POSITION action with label p69 calculates the following quantities: Quantity    Description  
p69.x the x-component of the atom position
p69.y the y-component of the atom position
p69.z the z-component of the atom positionp70: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=70
The POSITION action with label p70 calculates the following quantities: Quantity    Description  
p70.x the x-component of the atom position
p70.y the y-component of the atom position
p70.z the z-component of the atom positionp71: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=71
The POSITION action with label p71 calculates the following quantities: Quantity    Description  
p71.x the x-component of the atom position
p71.y the y-component of the atom position
p71.z the z-component of the atom positionp72: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=72
The POSITION action with label p72 calculates the following quantities: Quantity    Description  
p72.x the x-component of the atom position
p72.y the y-component of the atom position
p72.z the z-component of the atom positionp73: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=73
The POSITION action with label p73 calculates the following quantities: Quantity    Description  
p73.x the x-component of the atom position
p73.y the y-component of the atom position
p73.z the z-component of the atom positionp74: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=74
The POSITION action with label p74 calculates the following quantities: Quantity    Description  
p74.x the x-component of the atom position
p74.y the y-component of the atom position
p74.z the z-component of the atom positionp75: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=75
The POSITION action with label p75 calculates the following quantities: Quantity    Description  
p75.x the x-component of the atom position
p75.y the y-component of the atom position
p75.z the z-component of the atom positionp76: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=76
The POSITION action with label p76 calculates the following quantities: Quantity    Description  
p76.x the x-component of the atom position
p76.y the y-component of the atom position
p76.z the z-component of the atom positionp77: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=77
The POSITION action with label p77 calculates the following quantities: Quantity    Description  
p77.x the x-component of the atom position
p77.y the y-component of the atom position
p77.z the z-component of the atom positionp78: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=78
The POSITION action with label p78 calculates the following quantities: Quantity    Description  
p78.x the x-component of the atom position
p78.y the y-component of the atom position
p78.z the z-component of the atom positionp79: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=79
The POSITION action with label p79 calculates the following quantities: Quantity    Description  
p79.x the x-component of the atom position
p79.y the y-component of the atom position
p79.z the z-component of the atom positionp80: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=80
The POSITION action with label p80 calculates the following quantities: Quantity    Description  
p80.x the x-component of the atom position
p80.y the y-component of the atom position
p80.z the z-component of the atom positionp81: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=81
The POSITION action with label p81 calculates the following quantities: Quantity    Description  
p81.x the x-component of the atom position
p81.y the y-component of the atom position
p81.z the z-component of the atom positionp82: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=82
The POSITION action with label p82 calculates the following quantities: Quantity    Description  
p82.x the x-component of the atom position
p82.y the y-component of the atom position
p82.z the z-component of the atom positionp83: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=83
The POSITION action with label p83 calculates the following quantities: Quantity    Description  
p83.x the x-component of the atom position
p83.y the y-component of the atom position
p83.z the z-component of the atom positionp84: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=84
The POSITION action with label p84 calculates the following quantities: Quantity    Description  
p84.x the x-component of the atom position
p84.y the y-component of the atom position
p84.z the z-component of the atom positionp85: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=85
The POSITION action with label p85 calculates the following quantities: Quantity    Description  
p85.x the x-component of the atom position
p85.y the y-component of the atom position
p85.z the z-component of the atom positionp86: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=86
The POSITION action with label p86 calculates the following quantities: Quantity    Description  
p86.x the x-component of the atom position
p86.y the y-component of the atom position
p86.z the z-component of the atom positionp87: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=87
The POSITION action with label p87 calculates the following quantities: Quantity    Description  
p87.x the x-component of the atom position
p87.y the y-component of the atom position
p87.z the z-component of the atom positionp88: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=88
The POSITION action with label p88 calculates the following quantities: Quantity    Description  
p88.x the x-component of the atom position
p88.y the y-component of the atom position
p88.z the z-component of the atom positionp89: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=89
The POSITION action with label p89 calculates the following quantities: Quantity    Description  
p89.x the x-component of the atom position
p89.y the y-component of the atom position
p89.z the z-component of the atom positionp90: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=90
The POSITION action with label p90 calculates the following quantities: Quantity    Description  
p90.x the x-component of the atom position
p90.y the y-component of the atom position
p90.z the z-component of the atom positionp91: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=91
The POSITION action with label p91 calculates the following quantities: Quantity    Description  
p91.x the x-component of the atom position
p91.y the y-component of the atom position
p91.z the z-component of the atom positionp92: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=92
The POSITION action with label p92 calculates the following quantities: Quantity    Description  
p92.x the x-component of the atom position
p92.y the y-component of the atom position
p92.z the z-component of the atom positionp93: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=93
The POSITION action with label p93 calculates the following quantities: Quantity    Description  
p93.x the x-component of the atom position
p93.y the y-component of the atom position
p93.z the z-component of the atom positionp94: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=94
The POSITION action with label p94 calculates the following quantities: Quantity    Description  
p94.x the x-component of the atom position
p94.y the y-component of the atom position
p94.z the z-component of the atom positionp95: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=95
The POSITION action with label p95 calculates the following quantities: Quantity    Description  
p95.x the x-component of the atom position
p95.y the y-component of the atom position
p95.z the z-component of the atom positionp96: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=96
The POSITION action with label p96 calculates the following quantities: Quantity    Description  
p96.x the x-component of the atom position
p96.y the y-component of the atom position
p96.z the z-component of the atom positionp97: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=97
The POSITION action with label p97 calculates the following quantities: Quantity    Description  
p97.x the x-component of the atom position
p97.y the y-component of the atom position
p97.z the z-component of the atom positionp98: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=98
The POSITION action with label p98 calculates the following quantities: Quantity    Description  
p98.x the x-component of the atom position
p98.y the y-component of the atom position
p98.z the z-component of the atom positionp99: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=99
The POSITION action with label p99 calculates the following quantities: Quantity    Description  
p99.x the x-component of the atom position
p99.y the y-component of the atom position
p99.z the z-component of the atom positionp100: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=100
The POSITION action with label p100 calculates the following quantities: Quantity    Description  
p100.x the x-component of the atom position
p100.y the y-component of the atom position
p100.z the z-component of the atom positionp101: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=101
The POSITION action with label p101 calculates the following quantities: Quantity    Description  
p101.x the x-component of the atom position
p101.y the y-component of the atom position
p101.z the z-component of the atom positionp102: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=102
The POSITION action with label p102 calculates the following quantities: Quantity    Description  
p102.x the x-component of the atom position
p102.y the y-component of the atom position
p102.z the z-component of the atom positionp103: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=103
The POSITION action with label p103 calculates the following quantities: Quantity    Description  
p103.x the x-component of the atom position
p103.y the y-component of the atom position
p103.z the z-component of the atom positionp104: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=104
The POSITION action with label p104 calculates the following quantities: Quantity    Description  
p104.x the x-component of the atom position
p104.y the y-component of the atom position
p104.z the z-component of the atom positionp105: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=105
The POSITION action with label p105 calculates the following quantities: Quantity    Description  
p105.x the x-component of the atom position
p105.y the y-component of the atom position
p105.z the z-component of the atom positionp106: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=106
The POSITION action with label p106 calculates the following quantities: Quantity    Description  
p106.x the x-component of the atom position
p106.y the y-component of the atom position
p106.z the z-component of the atom positionp107: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=107
The POSITION action with label p107 calculates the following quantities: Quantity    Description  
p107.x the x-component of the atom position
p107.y the y-component of the atom position
p107.z the z-component of the atom positionp108: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=108
The POSITION action with label p108 calculates the following quantities: Quantity    Description  
p108.x the x-component of the atom position
p108.y the y-component of the atom position
p108.z the z-component of the atom positionp109: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=109
The POSITION action with label p109 calculates the following quantities: Quantity    Description  
p109.x the x-component of the atom position
p109.y the y-component of the atom position
p109.z the z-component of the atom positionp110: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=110
The POSITION action with label p110 calculates the following quantities: Quantity    Description  
p110.x the x-component of the atom position
p110.y the y-component of the atom position
p110.z the z-component of the atom positionp111: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=111
The POSITION action with label p111 calculates the following quantities: Quantity    Description  
p111.x the x-component of the atom position
p111.y the y-component of the atom position
p111.z the z-component of the atom positionp112: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=112
The POSITION action with label p112 calculates the following quantities: Quantity    Description  
p112.x the x-component of the atom position
p112.y the y-component of the atom position
p112.z the z-component of the atom positionp113: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=113
The POSITION action with label p113 calculates the following quantities: Quantity    Description  
p113.x the x-component of the atom position
p113.y the y-component of the atom position
p113.z the z-component of the atom positionp114: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=114
The POSITION action with label p114 calculates the following quantities: Quantity    Description  
p114.x the x-component of the atom position
p114.y the y-component of the atom position
p114.z the z-component of the atom positionp115: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=115
The POSITION action with label p115 calculates the following quantities: Quantity    Description  
p115.x the x-component of the atom position
p115.y the y-component of the atom position
p115.z the z-component of the atom positionp116: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=116
The POSITION action with label p116 calculates the following quantities: Quantity    Description  
p116.x the x-component of the atom position
p116.y the y-component of the atom position
p116.z the z-component of the atom positionp117: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=117
The POSITION action with label p117 calculates the following quantities: Quantity    Description  
p117.x the x-component of the atom position
p117.y the y-component of the atom position
p117.z the z-component of the atom positionp118: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=118
The POSITION action with label p118 calculates the following quantities: Quantity    Description  
p118.x the x-component of the atom position
p118.y the y-component of the atom position
p118.z the z-component of the atom positionp119: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=119
The POSITION action with label p119 calculates the following quantities: Quantity    Description  
p119.x the x-component of the atom position
p119.y the y-component of the atom position
p119.z the z-component of the atom positionp120: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=120
The POSITION action with label p120 calculates the following quantities: Quantity    Description  
p120.x the x-component of the atom position
p120.y the y-component of the atom position
p120.z the z-component of the atom positionp121: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=121
The POSITION action with label p121 calculates the following quantities: Quantity    Description  
p121.x the x-component of the atom position
p121.y the y-component of the atom position
p121.z the z-component of the atom positionp122: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=122
The POSITION action with label p122 calculates the following quantities: Quantity    Description  
p122.x the x-component of the atom position
p122.y the y-component of the atom position
p122.z the z-component of the atom positionp123: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=123
The POSITION action with label p123 calculates the following quantities: Quantity    Description  
p123.x the x-component of the atom position
p123.y the y-component of the atom position
p123.z the z-component of the atom positionp124: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=124
The POSITION action with label p124 calculates the following quantities: Quantity    Description  
p124.x the x-component of the atom position
p124.y the y-component of the atom position
p124.z the z-component of the atom positionp125: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=125
The POSITION action with label p125 calculates the following quantities: Quantity    Description  
p125.x the x-component of the atom position
p125.y the y-component of the atom position
p125.z the z-component of the atom positionp126: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=126
The POSITION action with label p126 calculates the following quantities: Quantity    Description  
p126.x the x-component of the atom position
p126.y the y-component of the atom position
p126.z the z-component of the atom positionp127: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=127
The POSITION action with label p127 calculates the following quantities: Quantity    Description  
p127.x the x-component of the atom position
p127.y the y-component of the atom position
p127.z the z-component of the atom positionp128: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=128
The POSITION action with label p128 calculates the following quantities: Quantity    Description  
p128.x the x-component of the atom position
p128.y the y-component of the atom position
p128.z the z-component of the atom positionp129: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=129
The POSITION action with label p129 calculates the following quantities: Quantity    Description  
p129.x the x-component of the atom position
p129.y the y-component of the atom position
p129.z the z-component of the atom positionp130: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=130
The POSITION action with label p130 calculates the following quantities: Quantity    Description  
p130.x the x-component of the atom position
p130.y the y-component of the atom position
p130.z the z-component of the atom positionp131: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=131
The POSITION action with label p131 calculates the following quantities: Quantity    Description  
p131.x the x-component of the atom position
p131.y the y-component of the atom position
p131.z the z-component of the atom positionp132: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=132
The POSITION action with label p132 calculates the following quantities: Quantity    Description  
p132.x the x-component of the atom position
p132.y the y-component of the atom position
p132.z the z-component of the atom positionp133: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=133
The POSITION action with label p133 calculates the following quantities: Quantity    Description  
p133.x the x-component of the atom position
p133.y the y-component of the atom position
p133.z the z-component of the atom positionp134: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=134
The POSITION action with label p134 calculates the following quantities: Quantity    Description  
p134.x the x-component of the atom position
p134.y the y-component of the atom position
p134.z the z-component of the atom positionp135: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=135
The POSITION action with label p135 calculates the following quantities: Quantity    Description  
p135.x the x-component of the atom position
p135.y the y-component of the atom position
p135.z the z-component of the atom positionp136: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=136
The POSITION action with label p136 calculates the following quantities: Quantity    Description  
p136.x the x-component of the atom position
p136.y the y-component of the atom position
p136.z the z-component of the atom positionp137: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=137
The POSITION action with label p137 calculates the following quantities: Quantity    Description  
p137.x the x-component of the atom position
p137.y the y-component of the atom position
p137.z the z-component of the atom positionp138: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=138
The POSITION action with label p138 calculates the following quantities: Quantity    Description  
p138.x the x-component of the atom position
p138.y the y-component of the atom position
p138.z the z-component of the atom positionp139: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=139
The POSITION action with label p139 calculates the following quantities: Quantity    Description  
p139.x the x-component of the atom position
p139.y the y-component of the atom position
p139.z the z-component of the atom positionp140: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=140
The POSITION action with label p140 calculates the following quantities: Quantity    Description  
p140.x the x-component of the atom position
p140.y the y-component of the atom position
p140.z the z-component of the atom positionp141: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=141
The POSITION action with label p141 calculates the following quantities: Quantity    Description  
p141.x the x-component of the atom position
p141.y the y-component of the atom position
p141.z the z-component of the atom positionp142: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=142
The POSITION action with label p142 calculates the following quantities: Quantity    Description  
p142.x the x-component of the atom position
p142.y the y-component of the atom position
p142.z the z-component of the atom positionp143: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=143
The POSITION action with label p143 calculates the following quantities: Quantity    Description  
p143.x the x-component of the atom position
p143.y the y-component of the atom position
p143.z the z-component of the atom positionp144: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=144
The POSITION action with label p144 calculates the following quantities: Quantity    Description  
p144.x the x-component of the atom position
p144.y the y-component of the atom position
p144.z the z-component of the atom positionp145: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=145
The POSITION action with label p145 calculates the following quantities: Quantity    Description  
p145.x the x-component of the atom position
p145.y the y-component of the atom position
p145.z the z-component of the atom positionp146: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=146
The POSITION action with label p146 calculates the following quantities: Quantity    Description  
p146.x the x-component of the atom position
p146.y the y-component of the atom position
p146.z the z-component of the atom positionp147: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=147
The POSITION action with label p147 calculates the following quantities: Quantity    Description  
p147.x the x-component of the atom position
p147.y the y-component of the atom position
p147.z the z-component of the atom positionp148: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=148
The POSITION action with label p148 calculates the following quantities: Quantity    Description  
p148.x the x-component of the atom position
p148.y the y-component of the atom position
p148.z the z-component of the atom positionp149: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=149
The POSITION action with label p149 calculates the following quantities: Quantity    Description  
p149.x the x-component of the atom position
p149.y the y-component of the atom position
p149.z the z-component of the atom positionp150: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=150
The POSITION action with label p150 calculates the following quantities: Quantity    Description  
p150.x the x-component of the atom position
p150.y the y-component of the atom position
p150.z the z-component of the atom positionp151: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=151
The POSITION action with label p151 calculates the following quantities: Quantity    Description  
p151.x the x-component of the atom position
p151.y the y-component of the atom position
p151.z the z-component of the atom positionp152: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=152
The POSITION action with label p152 calculates the following quantities: Quantity    Description  
p152.x the x-component of the atom position
p152.y the y-component of the atom position
p152.z the z-component of the atom positionp153: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=153
The POSITION action with label p153 calculates the following quantities: Quantity    Description  
p153.x the x-component of the atom position
p153.y the y-component of the atom position
p153.z the z-component of the atom positionp154: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=154
The POSITION action with label p154 calculates the following quantities: Quantity    Description  
p154.x the x-component of the atom position
p154.y the y-component of the atom position
p154.z the z-component of the atom positionp155: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=155
The POSITION action with label p155 calculates the following quantities: Quantity    Description  
p155.x the x-component of the atom position
p155.y the y-component of the atom position
p155.z the z-component of the atom positionp156: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=156
The POSITION action with label p156 calculates the following quantities: Quantity    Description  
p156.x the x-component of the atom position
p156.y the y-component of the atom position
p156.z the z-component of the atom positionp157: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=157
The POSITION action with label p157 calculates the following quantities: Quantity    Description  
p157.x the x-component of the atom position
p157.y the y-component of the atom position
p157.z the z-component of the atom positionp158: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=158
The POSITION action with label p158 calculates the following quantities: Quantity    Description  
p158.x the x-component of the atom position
p158.y the y-component of the atom position
p158.z the z-component of the atom positionp159: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=159
The POSITION action with label p159 calculates the following quantities: Quantity    Description  
p159.x the x-component of the atom position
p159.y the y-component of the atom position
p159.z the z-component of the atom positionp160: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=160
The POSITION action with label p160 calculates the following quantities: Quantity    Description  
p160.x the x-component of the atom position
p160.y the y-component of the atom position
p160.z the z-component of the atom positionp161: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=161
The POSITION action with label p161 calculates the following quantities: Quantity    Description  
p161.x the x-component of the atom position
p161.y the y-component of the atom position
p161.z the z-component of the atom positionp162: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=162
The POSITION action with label p162 calculates the following quantities: Quantity    Description  
p162.x the x-component of the atom position
p162.y the y-component of the atom position
p162.z the z-component of the atom positionp163: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=163
The POSITION action with label p163 calculates the following quantities: Quantity    Description  
p163.x the x-component of the atom position
p163.y the y-component of the atom position
p163.z the z-component of the atom positionp164: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=164
The POSITION action with label p164 calculates the following quantities: Quantity    Description  
p164.x the x-component of the atom position
p164.y the y-component of the atom position
p164.z the z-component of the atom positionp165: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=165
The POSITION action with label p165 calculates the following quantities: Quantity    Description  
p165.x the x-component of the atom position
p165.y the y-component of the atom position
p165.z the z-component of the atom positionp166: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=166
The POSITION action with label p166 calculates the following quantities: Quantity    Description  
p166.x the x-component of the atom position
p166.y the y-component of the atom position
p166.z the z-component of the atom positionp167: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=167
The POSITION action with label p167 calculates the following quantities: Quantity    Description  
p167.x the x-component of the atom position
p167.y the y-component of the atom position
p167.z the z-component of the atom positionp168: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=168
The POSITION action with label p168 calculates the following quantities: Quantity    Description  
p168.x the x-component of the atom position
p168.y the y-component of the atom position
p168.z the z-component of the atom positionp169: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=169
The POSITION action with label p169 calculates the following quantities: Quantity    Description  
p169.x the x-component of the atom position
p169.y the y-component of the atom position
p169.z the z-component of the atom positionp170: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=170
The POSITION action with label p170 calculates the following quantities: Quantity    Description  
p170.x the x-component of the atom position
p170.y the y-component of the atom position
p170.z the z-component of the atom positionp171: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=171
The POSITION action with label p171 calculates the following quantities: Quantity    Description  
p171.x the x-component of the atom position
p171.y the y-component of the atom position
p171.z the z-component of the atom positionp172: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=172
The POSITION action with label p172 calculates the following quantities: Quantity    Description  
p172.x the x-component of the atom position
p172.y the y-component of the atom position
p172.z the z-component of the atom positionp173: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=173
The POSITION action with label p173 calculates the following quantities: Quantity    Description  
p173.x the x-component of the atom position
p173.y the y-component of the atom position
p173.z the z-component of the atom positionp174: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=174
The POSITION action with label p174 calculates the following quantities: Quantity    Description  
p174.x the x-component of the atom position
p174.y the y-component of the atom position
p174.z the z-component of the atom positionp175: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=175
The POSITION action with label p175 calculates the following quantities: Quantity    Description  
p175.x the x-component of the atom position
p175.y the y-component of the atom position
p175.z the z-component of the atom positionp176: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=176
The POSITION action with label p176 calculates the following quantities: Quantity    Description  
p176.x the x-component of the atom position
p176.y the y-component of the atom position
p176.z the z-component of the atom positionp177: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=177
The POSITION action with label p177 calculates the following quantities: Quantity    Description  
p177.x the x-component of the atom position
p177.y the y-component of the atom position
p177.z the z-component of the atom positionp178: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=178
The POSITION action with label p178 calculates the following quantities: Quantity    Description  
p178.x the x-component of the atom position
p178.y the y-component of the atom position
p178.z the z-component of the atom positionp179: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=179
The POSITION action with label p179 calculates the following quantities: Quantity    Description  
p179.x the x-component of the atom position
p179.y the y-component of the atom position
p179.z the z-component of the atom positionp180: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=180
The POSITION action with label p180 calculates the following quantities: Quantity    Description  
p180.x the x-component of the atom position
p180.y the y-component of the atom position
p180.z the z-component of the atom positionp181: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=181
The POSITION action with label p181 calculates the following quantities: Quantity    Description  
p181.x the x-component of the atom position
p181.y the y-component of the atom position
p181.z the z-component of the atom positionp182: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=182
The POSITION action with label p182 calculates the following quantities: Quantity    Description  
p182.x the x-component of the atom position
p182.y the y-component of the atom position
p182.z the z-component of the atom positionp183: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=183
The POSITION action with label p183 calculates the following quantities: Quantity    Description  
p183.x the x-component of the atom position
p183.y the y-component of the atom position
p183.z the z-component of the atom positionp184: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=184
The POSITION action with label p184 calculates the following quantities: Quantity    Description  
p184.x the x-component of the atom position
p184.y the y-component of the atom position
p184.z the z-component of the atom positionp185: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=185
The POSITION action with label p185 calculates the following quantities: Quantity    Description  
p185.x the x-component of the atom position
p185.y the y-component of the atom position
p185.z the z-component of the atom positionp186: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=186
The POSITION action with label p186 calculates the following quantities: Quantity    Description  
p186.x the x-component of the atom position
p186.y the y-component of the atom position
p186.z the z-component of the atom positionp187: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=187
The POSITION action with label p187 calculates the following quantities: Quantity    Description  
p187.x the x-component of the atom position
p187.y the y-component of the atom position
p187.z the z-component of the atom positionp188: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=188
The POSITION action with label p188 calculates the following quantities: Quantity    Description  
p188.x the x-component of the atom position
p188.y the y-component of the atom position
p188.z the z-component of the atom positionp189: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=189
The POSITION action with label p189 calculates the following quantities: Quantity    Description  
p189.x the x-component of the atom position
p189.y the y-component of the atom position
p189.z the z-component of the atom positionp190: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=190
The POSITION action with label p190 calculates the following quantities: Quantity    Description  
p190.x the x-component of the atom position
p190.y the y-component of the atom position
p190.z the z-component of the atom positionp191: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=191
The POSITION action with label p191 calculates the following quantities: Quantity    Description  
p191.x the x-component of the atom position
p191.y the y-component of the atom position
p191.z the z-component of the atom positionp192: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=192
The POSITION action with label p192 calculates the following quantities: Quantity    Description  
p192.x the x-component of the atom position
p192.y the y-component of the atom position
p192.z the z-component of the atom positionp193: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=193
The POSITION action with label p193 calculates the following quantities: Quantity    Description  
p193.x the x-component of the atom position
p193.y the y-component of the atom position
p193.z the z-component of the atom positionp194: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=194
The POSITION action with label p194 calculates the following quantities: Quantity    Description  
p194.x the x-component of the atom position
p194.y the y-component of the atom position
p194.z the z-component of the atom positionp195: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=195
The POSITION action with label p195 calculates the following quantities: Quantity    Description  
p195.x the x-component of the atom position
p195.y the y-component of the atom position
p195.z the z-component of the atom positionp196: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=196
The POSITION action with label p196 calculates the following quantities: Quantity    Description  
p196.x the x-component of the atom position
p196.y the y-component of the atom position
p196.z the z-component of the atom positionp197: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=197
The POSITION action with label p197 calculates the following quantities: Quantity    Description  
p197.x the x-component of the atom position
p197.y the y-component of the atom position
p197.z the z-component of the atom positionp198: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=198
The POSITION action with label p198 calculates the following quantities: Quantity    Description  
p198.x the x-component of the atom position
p198.y the y-component of the atom position
p198.z the z-component of the atom positionp199: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=199
The POSITION action with label p199 calculates the following quantities: Quantity    Description  
p199.x the x-component of the atom position
p199.y the y-component of the atom position
p199.z the z-component of the atom positionp200: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=200
The POSITION action with label p200 calculates the following quantities: Quantity    Description  
p200.x the x-component of the atom position
p200.y the y-component of the atom position
p200.z the z-component of the atom positionp201: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=201
The POSITION action with label p201 calculates the following quantities: Quantity    Description  
p201.x the x-component of the atom position
p201.y the y-component of the atom position
p201.z the z-component of the atom positionp202: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=202
The POSITION action with label p202 calculates the following quantities: Quantity    Description  
p202.x the x-component of the atom position
p202.y the y-component of the atom position
p202.z the z-component of the atom positionp203: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=203
The POSITION action with label p203 calculates the following quantities: Quantity    Description  
p203.x the x-component of the atom position
p203.y the y-component of the atom position
p203.z the z-component of the atom positionp204: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=204
The POSITION action with label p204 calculates the following quantities: Quantity    Description  
p204.x the x-component of the atom position
p204.y the y-component of the atom position
p204.z the z-component of the atom positionp205: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=205
The POSITION action with label p205 calculates the following quantities: Quantity    Description  
p205.x the x-component of the atom position
p205.y the y-component of the atom position
p205.z the z-component of the atom positionp206: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=206
The POSITION action with label p206 calculates the following quantities: Quantity    Description  
p206.x the x-component of the atom position
p206.y the y-component of the atom position
p206.z the z-component of the atom positionp207: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=207
The POSITION action with label p207 calculates the following quantities: Quantity    Description  
p207.x the x-component of the atom position
p207.y the y-component of the atom position
p207.z the z-component of the atom positionp208: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=208
The POSITION action with label p208 calculates the following quantities: Quantity    Description  
p208.x the x-component of the atom position
p208.y the y-component of the atom position
p208.z the z-component of the atom positionp209: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=209
The POSITION action with label p209 calculates the following quantities: Quantity    Description  
p209.x the x-component of the atom position
p209.y the y-component of the atom position
p209.z the z-component of the atom positionp210: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=210
The POSITION action with label p210 calculates the following quantities: Quantity    Description  
p210.x the x-component of the atom position
p210.y the y-component of the atom position
p210.z the z-component of the atom positionp211: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=211
The POSITION action with label p211 calculates the following quantities: Quantity    Description  
p211.x the x-component of the atom position
p211.y the y-component of the atom position
p211.z the z-component of the atom positionp212: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=212
The POSITION action with label p212 calculates the following quantities: Quantity    Description  
p212.x the x-component of the atom position
p212.y the y-component of the atom position
p212.z the z-component of the atom positionp213: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=213
The POSITION action with label p213 calculates the following quantities: Quantity    Description  
p213.x the x-component of the atom position
p213.y the y-component of the atom position
p213.z the z-component of the atom positionp214: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=214
The POSITION action with label p214 calculates the following quantities: Quantity    Description  
p214.x the x-component of the atom position
p214.y the y-component of the atom position
p214.z the z-component of the atom positionp215: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=215
The POSITION action with label p215 calculates the following quantities: Quantity    Description  
p215.x the x-component of the atom position
p215.y the y-component of the atom position
p215.z the z-component of the atom positionp216: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=216
The POSITION action with label p216 calculates the following quantities: Quantity    Description  
p216.x the x-component of the atom position
p216.y the y-component of the atom position
p216.z the z-component of the atom positionp217: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=217
The POSITION action with label p217 calculates the following quantities: Quantity    Description  
p217.x the x-component of the atom position
p217.y the y-component of the atom position
p217.z the z-component of the atom positionp218: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=218
The POSITION action with label p218 calculates the following quantities: Quantity    Description  
p218.x the x-component of the atom position
p218.y the y-component of the atom position
p218.z the z-component of the atom positionp219: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=219
The POSITION action with label p219 calculates the following quantities: Quantity    Description  
p219.x the x-component of the atom position
p219.y the y-component of the atom position
p219.z the z-component of the atom positionp220: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=220
The POSITION action with label p220 calculates the following quantities: Quantity    Description  
p220.x the x-component of the atom position
p220.y the y-component of the atom position
p220.z the z-component of the atom positionp221: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=221
The POSITION action with label p221 calculates the following quantities: Quantity    Description  
p221.x the x-component of the atom position
p221.y the y-component of the atom position
p221.z the z-component of the atom positionp222: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=222
The POSITION action with label p222 calculates the following quantities: Quantity    Description  
p222.x the x-component of the atom position
p222.y the y-component of the atom position
p222.z the z-component of the atom positionp223: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=223
The POSITION action with label p223 calculates the following quantities: Quantity    Description  
p223.x the x-component of the atom position
p223.y the y-component of the atom position
p223.z the z-component of the atom positionp224: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=224
The POSITION action with label p224 calculates the following quantities: Quantity    Description  
p224.x the x-component of the atom position
p224.y the y-component of the atom position
p224.z the z-component of the atom positionp225: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=225
The POSITION action with label p225 calculates the following quantities: Quantity    Description  
p225.x the x-component of the atom position
p225.y the y-component of the atom position
p225.z the z-component of the atom positionp226: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=226
The POSITION action with label p226 calculates the following quantities: Quantity    Description  
p226.x the x-component of the atom position
p226.y the y-component of the atom position
p226.z the z-component of the atom positionp227: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=227
The POSITION action with label p227 calculates the following quantities: Quantity    Description  
p227.x the x-component of the atom position
p227.y the y-component of the atom position
p227.z the z-component of the atom positionp228: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=228
The POSITION action with label p228 calculates the following quantities: Quantity    Description  
p228.x the x-component of the atom position
p228.y the y-component of the atom position
p228.z the z-component of the atom positionp229: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=229
The POSITION action with label p229 calculates the following quantities: Quantity    Description  
p229.x the x-component of the atom position
p229.y the y-component of the atom position
p229.z the z-component of the atom positionp230: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=230
The POSITION action with label p230 calculates the following quantities: Quantity    Description  
p230.x the x-component of the atom position
p230.y the y-component of the atom position
p230.z the z-component of the atom positionp231: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=231
The POSITION action with label p231 calculates the following quantities: Quantity    Description  
p231.x the x-component of the atom position
p231.y the y-component of the atom position
p231.z the z-component of the atom positionp232: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=232
The POSITION action with label p232 calculates the following quantities: Quantity    Description  
p232.x the x-component of the atom position
p232.y the y-component of the atom position
p232.z the z-component of the atom positionp233: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=233
The POSITION action with label p233 calculates the following quantities: Quantity    Description  
p233.x the x-component of the atom position
p233.y the y-component of the atom position
p233.z the z-component of the atom positionp234: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=234
The POSITION action with label p234 calculates the following quantities: Quantity    Description  
p234.x the x-component of the atom position
p234.y the y-component of the atom position
p234.z the z-component of the atom positionp235: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=235
The POSITION action with label p235 calculates the following quantities: Quantity    Description  
p235.x the x-component of the atom position
p235.y the y-component of the atom position
p235.z the z-component of the atom positionp236: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=236
The POSITION action with label p236 calculates the following quantities: Quantity    Description  
p236.x the x-component of the atom position
p236.y the y-component of the atom position
p236.z the z-component of the atom positionp237: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=237
The POSITION action with label p237 calculates the following quantities: Quantity    Description  
p237.x the x-component of the atom position
p237.y the y-component of the atom position
p237.z the z-component of the atom positionp238: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=238
The POSITION action with label p238 calculates the following quantities: Quantity    Description  
p238.x the x-component of the atom position
p238.y the y-component of the atom position
p238.z the z-component of the atom positionp239: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=239
The POSITION action with label p239 calculates the following quantities: Quantity    Description  
p239.x the x-component of the atom position
p239.y the y-component of the atom position
p239.z the z-component of the atom positionp240: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=240
The POSITION action with label p240 calculates the following quantities: Quantity    Description  
p240.x the x-component of the atom position
p240.y the y-component of the atom position
p240.z the z-component of the atom positionp241: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=241
The POSITION action with label p241 calculates the following quantities: Quantity    Description  
p241.x the x-component of the atom position
p241.y the y-component of the atom position
p241.z the z-component of the atom positionp242: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=242
The POSITION action with label p242 calculates the following quantities: Quantity    Description  
p242.x the x-component of the atom position
p242.y the y-component of the atom position
p242.z the z-component of the atom positionp243: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=243
The POSITION action with label p243 calculates the following quantities: Quantity    Description  
p243.x the x-component of the atom position
p243.y the y-component of the atom position
p243.z the z-component of the atom positionp244: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=244
The POSITION action with label p244 calculates the following quantities: Quantity    Description  
p244.x the x-component of the atom position
p244.y the y-component of the atom position
p244.z the z-component of the atom positionp245: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=245
The POSITION action with label p245 calculates the following quantities: Quantity    Description  
p245.x the x-component of the atom position
p245.y the y-component of the atom position
p245.z the z-component of the atom positionp246: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=246
The POSITION action with label p246 calculates the following quantities: Quantity    Description  
p246.x the x-component of the atom position
p246.y the y-component of the atom position
p246.z the z-component of the atom positionp247: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=247
The POSITION action with label p247 calculates the following quantities: Quantity    Description  
p247.x the x-component of the atom position
p247.y the y-component of the atom position
p247.z the z-component of the atom positionp248: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=248
The POSITION action with label p248 calculates the following quantities: Quantity    Description  
p248.x the x-component of the atom position
p248.y the y-component of the atom position
p248.z the z-component of the atom positionp249: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=249
The POSITION action with label p249 calculates the following quantities: Quantity    Description  
p249.x the x-component of the atom position
p249.y the y-component of the atom position
p249.z the z-component of the atom positionp250: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=250
The POSITION action with label p250 calculates the following quantities: Quantity    Description  
p250.x the x-component of the atom position
p250.y the y-component of the atom position
p250.z the z-component of the atom positionp251: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=251
The POSITION action with label p251 calculates the following quantities: Quantity    Description  
p251.x the x-component of the atom position
p251.y the y-component of the atom position
p251.z the z-component of the atom positionp252: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=252
The POSITION action with label p252 calculates the following quantities: Quantity    Description  
p252.x the x-component of the atom position
p252.y the y-component of the atom position
p252.z the z-component of the atom positionp253: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=253
The POSITION action with label p253 calculates the following quantities: Quantity    Description  
p253.x the x-component of the atom position
p253.y the y-component of the atom position
p253.z the z-component of the atom positionp254: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=254
The POSITION action with label p254 calculates the following quantities: Quantity    Description  
p254.x the x-component of the atom position
p254.y the y-component of the atom position
p254.z the z-component of the atom positionp255: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=255
The POSITION action with label p255 calculates the following quantities: Quantity    Description  
p255.x the x-component of the atom position
p255.y the y-component of the atom position
p255.z the z-component of the atom positionp256: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=256
The POSITION action with label p256 calculates the following quantities: Quantity    Description  
p256.x the x-component of the atom position
p256.y the y-component of the atom position
p256.z the z-component of the atom positionp257: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=257
The POSITION action with label p257 calculates the following quantities: Quantity    Description  
p257.x the x-component of the atom position
p257.y the y-component of the atom position
p257.z the z-component of the atom positionp258: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=258
The POSITION action with label p258 calculates the following quantities: Quantity    Description  
p258.x the x-component of the atom position
p258.y the y-component of the atom position
p258.z the z-component of the atom positionp259: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=259
The POSITION action with label p259 calculates the following quantities: Quantity    Description  
p259.x the x-component of the atom position
p259.y the y-component of the atom position
p259.z the z-component of the atom positionp260: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=260
The POSITION action with label p260 calculates the following quantities: Quantity    Description  
p260.x the x-component of the atom position
p260.y the y-component of the atom position
p260.z the z-component of the atom positionp261: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=261
The POSITION action with label p261 calculates the following quantities: Quantity    Description  
p261.x the x-component of the atom position
p261.y the y-component of the atom position
p261.z the z-component of the atom positionp262: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=262
The POSITION action with label p262 calculates the following quantities: Quantity    Description  
p262.x the x-component of the atom position
p262.y the y-component of the atom position
p262.z the z-component of the atom positionp263: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=263
The POSITION action with label p263 calculates the following quantities: Quantity    Description  
p263.x the x-component of the atom position
p263.y the y-component of the atom position
p263.z the z-component of the atom positionp264: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=264
The POSITION action with label p264 calculates the following quantities: Quantity    Description  
p264.x the x-component of the atom position
p264.y the y-component of the atom position
p264.z the z-component of the atom positionp265: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=265
The POSITION action with label p265 calculates the following quantities: Quantity    Description  
p265.x the x-component of the atom position
p265.y the y-component of the atom position
p265.z the z-component of the atom positionp266: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=266
The POSITION action with label p266 calculates the following quantities: Quantity    Description  
p266.x the x-component of the atom position
p266.y the y-component of the atom position
p266.z the z-component of the atom positionp267: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=267
The POSITION action with label p267 calculates the following quantities: Quantity    Description  
p267.x the x-component of the atom position
p267.y the y-component of the atom position
p267.z the z-component of the atom positionp268: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=268
The POSITION action with label p268 calculates the following quantities: Quantity    Description  
p268.x the x-component of the atom position
p268.y the y-component of the atom position
p268.z the z-component of the atom positionp269: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=269
The POSITION action with label p269 calculates the following quantities: Quantity    Description  
p269.x the x-component of the atom position
p269.y the y-component of the atom position
p269.z the z-component of the atom positionp270: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=270
The POSITION action with label p270 calculates the following quantities: Quantity    Description  
p270.x the x-component of the atom position
p270.y the y-component of the atom position
p270.z the z-component of the atom positionp271: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=271
The POSITION action with label p271 calculates the following quantities: Quantity    Description  
p271.x the x-component of the atom position
p271.y the y-component of the atom position
p271.z the z-component of the atom positionp272: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=272
The POSITION action with label p272 calculates the following quantities: Quantity    Description  
p272.x the x-component of the atom position
p272.y the y-component of the atom position
p272.z the z-component of the atom positionp273: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=273
The POSITION action with label p273 calculates the following quantities: Quantity    Description  
p273.x the x-component of the atom position
p273.y the y-component of the atom position
p273.z the z-component of the atom positionp274: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=274
The POSITION action with label p274 calculates the following quantities: Quantity    Description  
p274.x the x-component of the atom position
p274.y the y-component of the atom position
p274.z the z-component of the atom positionp275: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=275
The POSITION action with label p275 calculates the following quantities: Quantity    Description  
p275.x the x-component of the atom position
p275.y the y-component of the atom position
p275.z the z-component of the atom positionp276: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=276
The POSITION action with label p276 calculates the following quantities: Quantity    Description  
p276.x the x-component of the atom position
p276.y the y-component of the atom position
p276.z the z-component of the atom positionp277: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=277
The POSITION action with label p277 calculates the following quantities: Quantity    Description  
p277.x the x-component of the atom position
p277.y the y-component of the atom position
p277.z the z-component of the atom positionp278: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=278
The POSITION action with label p278 calculates the following quantities: Quantity    Description  
p278.x the x-component of the atom position
p278.y the y-component of the atom position
p278.z the z-component of the atom positionp279: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=279
The POSITION action with label p279 calculates the following quantities: Quantity    Description  
p279.x the x-component of the atom position
p279.y the y-component of the atom position
p279.z the z-component of the atom positionp280: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=280
The POSITION action with label p280 calculates the following quantities: Quantity    Description  
p280.x the x-component of the atom position
p280.y the y-component of the atom position
p280.z the z-component of the atom positionp281: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=281
The POSITION action with label p281 calculates the following quantities: Quantity    Description  
p281.x the x-component of the atom position
p281.y the y-component of the atom position
p281.z the z-component of the atom positionp282: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=282
The POSITION action with label p282 calculates the following quantities: Quantity    Description  
p282.x the x-component of the atom position
p282.y the y-component of the atom position
p282.z the z-component of the atom positionp283: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=283
The POSITION action with label p283 calculates the following quantities: Quantity    Description  
p283.x the x-component of the atom position
p283.y the y-component of the atom position
p283.z the z-component of the atom positionp284: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=284
The POSITION action with label p284 calculates the following quantities: Quantity    Description  
p284.x the x-component of the atom position
p284.y the y-component of the atom position
p284.z the z-component of the atom positionp285: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=285
The POSITION action with label p285 calculates the following quantities: Quantity    Description  
p285.x the x-component of the atom position
p285.y the y-component of the atom position
p285.z the z-component of the atom positionp286: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=286
The POSITION action with label p286 calculates the following quantities: Quantity    Description  
p286.x the x-component of the atom position
p286.y the y-component of the atom position
p286.z the z-component of the atom positionp287: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=287
The POSITION action with label p287 calculates the following quantities: Quantity    Description  
p287.x the x-component of the atom position
p287.y the y-component of the atom position
p287.z the z-component of the atom positionp288: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=288
The POSITION action with label p288 calculates the following quantities: Quantity    Description  
p288.x the x-component of the atom position
p288.y the y-component of the atom position
p288.z the z-component of the atom positionp289: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=289
The POSITION action with label p289 calculates the following quantities: Quantity    Description  
p289.x the x-component of the atom position
p289.y the y-component of the atom position
p289.z the z-component of the atom positionp290: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=290
The POSITION action with label p290 calculates the following quantities: Quantity    Description  
p290.x the x-component of the atom position
p290.y the y-component of the atom position
p290.z the z-component of the atom positionp291: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=291
The POSITION action with label p291 calculates the following quantities: Quantity    Description  
p291.x the x-component of the atom position
p291.y the y-component of the atom position
p291.z the z-component of the atom positionp292: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=292
The POSITION action with label p292 calculates the following quantities: Quantity    Description  
p292.x the x-component of the atom position
p292.y the y-component of the atom position
p292.z the z-component of the atom positionp293: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=293
The POSITION action with label p293 calculates the following quantities: Quantity    Description  
p293.x the x-component of the atom position
p293.y the y-component of the atom position
p293.z the z-component of the atom positionp294: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=294
The POSITION action with label p294 calculates the following quantities: Quantity    Description  
p294.x the x-component of the atom position
p294.y the y-component of the atom position
p294.z the z-component of the atom positionp295: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=295
The POSITION action with label p295 calculates the following quantities: Quantity    Description  
p295.x the x-component of the atom position
p295.y the y-component of the atom position
p295.z the z-component of the atom positionp296: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=296
The POSITION action with label p296 calculates the following quantities: Quantity    Description  
p296.x the x-component of the atom position
p296.y the y-component of the atom position
p296.z the z-component of the atom positionp297: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=297
The POSITION action with label p297 calculates the following quantities: Quantity    Description  
p297.x the x-component of the atom position
p297.y the y-component of the atom position
p297.z the z-component of the atom positionp298: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=298
The POSITION action with label p298 calculates the following quantities: Quantity    Description  
p298.x the x-component of the atom position
p298.y the y-component of the atom position
p298.z the z-component of the atom positionp299: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=299
The POSITION action with label p299 calculates the following quantities: Quantity    Description  
p299.x the x-component of the atom position
p299.y the y-component of the atom position
p299.z the z-component of the atom positionp300: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=300
The POSITION action with label p300 calculates the following quantities: Quantity    Description  
p300.x the x-component of the atom position
p300.y the y-component of the atom position
p300.z the z-component of the atom positionp301: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=301
The POSITION action with label p301 calculates the following quantities: Quantity    Description  
p301.x the x-component of the atom position
p301.y the y-component of the atom position
p301.z the z-component of the atom positionp302: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=302
The POSITION action with label p302 calculates the following quantities: Quantity    Description  
p302.x the x-component of the atom position
p302.y the y-component of the atom position
p302.z the z-component of the atom positionp303: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=303
The POSITION action with label p303 calculates the following quantities: Quantity    Description  
p303.x the x-component of the atom position
p303.y the y-component of the atom position
p303.z the z-component of the atom positionp304: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=304
The POSITION action with label p304 calculates the following quantities: Quantity    Description  
p304.x the x-component of the atom position
p304.y the y-component of the atom position
p304.z the z-component of the atom positionp305: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=305
The POSITION action with label p305 calculates the following quantities: Quantity    Description  
p305.x the x-component of the atom position
p305.y the y-component of the atom position
p305.z the z-component of the atom positionp306: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=306
The POSITION action with label p306 calculates the following quantities: Quantity    Description  
p306.x the x-component of the atom position
p306.y the y-component of the atom position
p306.z the z-component of the atom positionp307: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=307
The POSITION action with label p307 calculates the following quantities: Quantity    Description  
p307.x the x-component of the atom position
p307.y the y-component of the atom position
p307.z the z-component of the atom positionp308: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=308
The POSITION action with label p308 calculates the following quantities: Quantity    Description  
p308.x the x-component of the atom position
p308.y the y-component of the atom position
p308.z the z-component of the atom positionp309: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=309
The POSITION action with label p309 calculates the following quantities: Quantity    Description  
p309.x the x-component of the atom position
p309.y the y-component of the atom position
p309.z the z-component of the atom positionp310: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=310
The POSITION action with label p310 calculates the following quantities: Quantity    Description  
p310.x the x-component of the atom position
p310.y the y-component of the atom position
p310.z the z-component of the atom positionp311: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=311
The POSITION action with label p311 calculates the following quantities: Quantity    Description  
p311.x the x-component of the atom position
p311.y the y-component of the atom position
p311.z the z-component of the atom positionp312: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=312
The POSITION action with label p312 calculates the following quantities: Quantity    Description  
p312.x the x-component of the atom position
p312.y the y-component of the atom position
p312.z the z-component of the atom positionp313: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=313
The POSITION action with label p313 calculates the following quantities: Quantity    Description  
p313.x the x-component of the atom position
p313.y the y-component of the atom position
p313.z the z-component of the atom positionp314: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=314
The POSITION action with label p314 calculates the following quantities: Quantity    Description  
p314.x the x-component of the atom position
p314.y the y-component of the atom position
p314.z the z-component of the atom positionp315: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=315
The POSITION action with label p315 calculates the following quantities: Quantity    Description  
p315.x the x-component of the atom position
p315.y the y-component of the atom position
p315.z the z-component of the atom positionp316: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=316
The POSITION action with label p316 calculates the following quantities: Quantity    Description  
p316.x the x-component of the atom position
p316.y the y-component of the atom position
p316.z the z-component of the atom positionp317: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=317
The POSITION action with label p317 calculates the following quantities: Quantity    Description  
p317.x the x-component of the atom position
p317.y the y-component of the atom position
p317.z the z-component of the atom positionp318: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=318
The POSITION action with label p318 calculates the following quantities: Quantity    Description  
p318.x the x-component of the atom position
p318.y the y-component of the atom position
p318.z the z-component of the atom positionp319: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=319
The POSITION action with label p319 calculates the following quantities: Quantity    Description  
p319.x the x-component of the atom position
p319.y the y-component of the atom position
p319.z the z-component of the atom positionp320: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=320
The POSITION action with label p320 calculates the following quantities: Quantity    Description  
p320.x the x-component of the atom position
p320.y the y-component of the atom position
p320.z the z-component of the atom positionp321: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=321
The POSITION action with label p321 calculates the following quantities: Quantity    Description  
p321.x the x-component of the atom position
p321.y the y-component of the atom position
p321.z the z-component of the atom positionp322: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=322
The POSITION action with label p322 calculates the following quantities: Quantity    Description  
p322.x the x-component of the atom position
p322.y the y-component of the atom position
p322.z the z-component of the atom positionp323: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=323
The POSITION action with label p323 calculates the following quantities: Quantity    Description  
p323.x the x-component of the atom position
p323.y the y-component of the atom position
p323.z the z-component of the atom positionp324: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=324
The POSITION action with label p324 calculates the following quantities: Quantity    Description  
p324.x the x-component of the atom position
p324.y the y-component of the atom position
p324.z the z-component of the atom positionp325: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=325
The POSITION action with label p325 calculates the following quantities: Quantity    Description  
p325.x the x-component of the atom position
p325.y the y-component of the atom position
p325.z the z-component of the atom positionp326: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=326
The POSITION action with label p326 calculates the following quantities: Quantity    Description  
p326.x the x-component of the atom position
p326.y the y-component of the atom position
p326.z the z-component of the atom positionp327: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=327
The POSITION action with label p327 calculates the following quantities: Quantity    Description  
p327.x the x-component of the atom position
p327.y the y-component of the atom position
p327.z the z-component of the atom positionp328: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=328
The POSITION action with label p328 calculates the following quantities: Quantity    Description  
p328.x the x-component of the atom position
p328.y the y-component of the atom position
p328.z the z-component of the atom positionp329: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=329
The POSITION action with label p329 calculates the following quantities: Quantity    Description  
p329.x the x-component of the atom position
p329.y the y-component of the atom position
p329.z the z-component of the atom positionp330: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=330
The POSITION action with label p330 calculates the following quantities: Quantity    Description  
p330.x the x-component of the atom position
p330.y the y-component of the atom position
p330.z the z-component of the atom positionp331: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=331
The POSITION action with label p331 calculates the following quantities: Quantity    Description  
p331.x the x-component of the atom position
p331.y the y-component of the atom position
p331.z the z-component of the atom positionp332: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=332
The POSITION action with label p332 calculates the following quantities: Quantity    Description  
p332.x the x-component of the atom position
p332.y the y-component of the atom position
p332.z the z-component of the atom positionp333: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=333
The POSITION action with label p333 calculates the following quantities: Quantity    Description  
p333.x the x-component of the atom position
p333.y the y-component of the atom position
p333.z the z-component of the atom positionp334: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=334
The POSITION action with label p334 calculates the following quantities: Quantity    Description  
p334.x the x-component of the atom position
p334.y the y-component of the atom position
p334.z the z-component of the atom positionp335: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=335
The POSITION action with label p335 calculates the following quantities: Quantity    Description  
p335.x the x-component of the atom position
p335.y the y-component of the atom position
p335.z the z-component of the atom positionp336: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=336
The POSITION action with label p336 calculates the following quantities: Quantity    Description  
p336.x the x-component of the atom position
p336.y the y-component of the atom position
p336.z the z-component of the atom positionp337: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=337
The POSITION action with label p337 calculates the following quantities: Quantity    Description  
p337.x the x-component of the atom position
p337.y the y-component of the atom position
p337.z the z-component of the atom positionp338: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=338
The POSITION action with label p338 calculates the following quantities: Quantity    Description  
p338.x the x-component of the atom position
p338.y the y-component of the atom position
p338.z the z-component of the atom positionp339: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=339
The POSITION action with label p339 calculates the following quantities: Quantity    Description  
p339.x the x-component of the atom position
p339.y the y-component of the atom position
p339.z the z-component of the atom positionp340: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=340
The POSITION action with label p340 calculates the following quantities: Quantity    Description  
p340.x the x-component of the atom position
p340.y the y-component of the atom position
p340.z the z-component of the atom positionp341: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=341
The POSITION action with label p341 calculates the following quantities: Quantity    Description  
p341.x the x-component of the atom position
p341.y the y-component of the atom position
p341.z the z-component of the atom positionp342: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=342
The POSITION action with label p342 calculates the following quantities: Quantity    Description  
p342.x the x-component of the atom position
p342.y the y-component of the atom position
p342.z the z-component of the atom positionp343: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=343
The POSITION action with label p343 calculates the following quantities: Quantity    Description  
p343.x the x-component of the atom position
p343.y the y-component of the atom position
p343.z the z-component of the atom positionp344: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=344
The POSITION action with label p344 calculates the following quantities: Quantity    Description  
p344.x the x-component of the atom position
p344.y the y-component of the atom position
p344.z the z-component of the atom positionp345: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=345
The POSITION action with label p345 calculates the following quantities: Quantity    Description  
p345.x the x-component of the atom position
p345.y the y-component of the atom position
p345.z the z-component of the atom positionp346: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=346
The POSITION action with label p346 calculates the following quantities: Quantity    Description  
p346.x the x-component of the atom position
p346.y the y-component of the atom position
p346.z the z-component of the atom positionp347: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=347
The POSITION action with label p347 calculates the following quantities: Quantity    Description  
p347.x the x-component of the atom position
p347.y the y-component of the atom position
p347.z the z-component of the atom positionp348: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=348
The POSITION action with label p348 calculates the following quantities: Quantity    Description  
p348.x the x-component of the atom position
p348.y the y-component of the atom position
p348.z the z-component of the atom positionp349: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=349
The POSITION action with label p349 calculates the following quantities: Quantity    Description  
p349.x the x-component of the atom position
p349.y the y-component of the atom position
p349.z the z-component of the atom positionp350: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=350
The POSITION action with label p350 calculates the following quantities: Quantity    Description  
p350.x the x-component of the atom position
p350.y the y-component of the atom position
p350.z the z-component of the atom positionp351: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=351
The POSITION action with label p351 calculates the following quantities: Quantity    Description  
p351.x the x-component of the atom position
p351.y the y-component of the atom position
p351.z the z-component of the atom positionp352: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=352
The POSITION action with label p352 calculates the following quantities: Quantity    Description  
p352.x the x-component of the atom position
p352.y the y-component of the atom position
p352.z the z-component of the atom positionp353: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=353
The POSITION action with label p353 calculates the following quantities: Quantity    Description  
p353.x the x-component of the atom position
p353.y the y-component of the atom position
p353.z the z-component of the atom positionp354: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=354
The POSITION action with label p354 calculates the following quantities: Quantity    Description  
p354.x the x-component of the atom position
p354.y the y-component of the atom position
p354.z the z-component of the atom positionp355: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=355
The POSITION action with label p355 calculates the following quantities: Quantity    Description  
p355.x the x-component of the atom position
p355.y the y-component of the atom position
p355.z the z-component of the atom positionp356: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=356
The POSITION action with label p356 calculates the following quantities: Quantity    Description  
p356.x the x-component of the atom position
p356.y the y-component of the atom position
p356.z the z-component of the atom positionp357: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=357
The POSITION action with label p357 calculates the following quantities: Quantity    Description  
p357.x the x-component of the atom position
p357.y the y-component of the atom position
p357.z the z-component of the atom positionp358: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=358
The POSITION action with label p358 calculates the following quantities: Quantity    Description  
p358.x the x-component of the atom position
p358.y the y-component of the atom position
p358.z the z-component of the atom positionp359: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=359
The POSITION action with label p359 calculates the following quantities: Quantity    Description  
p359.x the x-component of the atom position
p359.y the y-component of the atom position
p359.z the z-component of the atom positionp360: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=360
The POSITION action with label p360 calculates the following quantities: Quantity    Description  
p360.x the x-component of the atom position
p360.y the y-component of the atom position
p360.z the z-component of the atom positionp361: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=361
The POSITION action with label p361 calculates the following quantities: Quantity    Description  
p361.x the x-component of the atom position
p361.y the y-component of the atom position
p361.z the z-component of the atom positionp362: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=362
The POSITION action with label p362 calculates the following quantities: Quantity    Description  
p362.x the x-component of the atom position
p362.y the y-component of the atom position
p362.z the z-component of the atom positionp363: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=363
The POSITION action with label p363 calculates the following quantities: Quantity    Description  
p363.x the x-component of the atom position
p363.y the y-component of the atom position
p363.z the z-component of the atom positionp364: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=364
The POSITION action with label p364 calculates the following quantities: Quantity    Description  
p364.x the x-component of the atom position
p364.y the y-component of the atom position
p364.z the z-component of the atom positionp365: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=365
The POSITION action with label p365 calculates the following quantities: Quantity    Description  
p365.x the x-component of the atom position
p365.y the y-component of the atom position
p365.z the z-component of the atom positionp366: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=366
The POSITION action with label p366 calculates the following quantities: Quantity    Description  
p366.x the x-component of the atom position
p366.y the y-component of the atom position
p366.z the z-component of the atom positionp367: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=367
The POSITION action with label p367 calculates the following quantities: Quantity    Description  
p367.x the x-component of the atom position
p367.y the y-component of the atom position
p367.z the z-component of the atom positionp368: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=368
The POSITION action with label p368 calculates the following quantities: Quantity    Description  
p368.x the x-component of the atom position
p368.y the y-component of the atom position
p368.z the z-component of the atom positionp369: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=369
The POSITION action with label p369 calculates the following quantities: Quantity    Description  
p369.x the x-component of the atom position
p369.y the y-component of the atom position
p369.z the z-component of the atom positionp370: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=370
The POSITION action with label p370 calculates the following quantities: Quantity    Description  
p370.x the x-component of the atom position
p370.y the y-component of the atom position
p370.z the z-component of the atom positionp371: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=371
The POSITION action with label p371 calculates the following quantities: Quantity    Description  
p371.x the x-component of the atom position
p371.y the y-component of the atom position
p371.z the z-component of the atom positionp372: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=372
The POSITION action with label p372 calculates the following quantities: Quantity    Description  
p372.x the x-component of the atom position
p372.y the y-component of the atom position
p372.z the z-component of the atom positionp373: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=373
The POSITION action with label p373 calculates the following quantities: Quantity    Description  
p373.x the x-component of the atom position
p373.y the y-component of the atom position
p373.z the z-component of the atom positionp374: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=374
The POSITION action with label p374 calculates the following quantities: Quantity    Description  
p374.x the x-component of the atom position
p374.y the y-component of the atom position
p374.z the z-component of the atom positionp375: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=375
The POSITION action with label p375 calculates the following quantities: Quantity    Description  
p375.x the x-component of the atom position
p375.y the y-component of the atom position
p375.z the z-component of the atom positionp376: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=376
The POSITION action with label p376 calculates the following quantities: Quantity    Description  
p376.x the x-component of the atom position
p376.y the y-component of the atom position
p376.z the z-component of the atom positionp377: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=377
The POSITION action with label p377 calculates the following quantities: Quantity    Description  
p377.x the x-component of the atom position
p377.y the y-component of the atom position
p377.z the z-component of the atom positionp378: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=378
The POSITION action with label p378 calculates the following quantities: Quantity    Description  
p378.x the x-component of the atom position
p378.y the y-component of the atom position
p378.z the z-component of the atom positionp379: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=379
The POSITION action with label p379 calculates the following quantities: Quantity    Description  
p379.x the x-component of the atom position
p379.y the y-component of the atom position
p379.z the z-component of the atom positionp380: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=380
The POSITION action with label p380 calculates the following quantities: Quantity    Description  
p380.x the x-component of the atom position
p380.y the y-component of the atom position
p380.z the z-component of the atom positionp381: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=381
The POSITION action with label p381 calculates the following quantities: Quantity    Description  
p381.x the x-component of the atom position
p381.y the y-component of the atom position
p381.z the z-component of the atom positionp382: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=382
The POSITION action with label p382 calculates the following quantities: Quantity    Description  
p382.x the x-component of the atom position
p382.y the y-component of the atom position
p382.z the z-component of the atom positionp383: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=383
The POSITION action with label p383 calculates the following quantities: Quantity    Description  
p383.x the x-component of the atom position
p383.y the y-component of the atom position
p383.z the z-component of the atom positionp384: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=384
The POSITION action with label p384 calculates the following quantities: Quantity    Description  
p384.x the x-component of the atom position
p384.y the y-component of the atom position
p384.z the z-component of the atom positionp385: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=385
The POSITION action with label p385 calculates the following quantities: Quantity    Description  
p385.x the x-component of the atom position
p385.y the y-component of the atom position
p385.z the z-component of the atom positionp386: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=386
The POSITION action with label p386 calculates the following quantities: Quantity    Description  
p386.x the x-component of the atom position
p386.y the y-component of the atom position
p386.z the z-component of the atom positionp387: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=387
The POSITION action with label p387 calculates the following quantities: Quantity    Description  
p387.x the x-component of the atom position
p387.y the y-component of the atom position
p387.z the z-component of the atom positionp388: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=388
The POSITION action with label p388 calculates the following quantities: Quantity    Description  
p388.x the x-component of the atom position
p388.y the y-component of the atom position
p388.z the z-component of the atom positionp389: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=389
The POSITION action with label p389 calculates the following quantities: Quantity    Description  
p389.x the x-component of the atom position
p389.y the y-component of the atom position
p389.z the z-component of the atom positionp390: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=390
The POSITION action with label p390 calculates the following quantities: Quantity    Description  
p390.x the x-component of the atom position
p390.y the y-component of the atom position
p390.z the z-component of the atom positionp391: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=391
The POSITION action with label p391 calculates the following quantities: Quantity    Description  
p391.x the x-component of the atom position
p391.y the y-component of the atom position
p391.z the z-component of the atom positionp392: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=392
The POSITION action with label p392 calculates the following quantities: Quantity    Description  
p392.x the x-component of the atom position
p392.y the y-component of the atom position
p392.z the z-component of the atom positionp393: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=393
The POSITION action with label p393 calculates the following quantities: Quantity    Description  
p393.x the x-component of the atom position
p393.y the y-component of the atom position
p393.z the z-component of the atom positionp394: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=394
The POSITION action with label p394 calculates the following quantities: Quantity    Description  
p394.x the x-component of the atom position
p394.y the y-component of the atom position
p394.z the z-component of the atom positionp395: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=395
The POSITION action with label p395 calculates the following quantities: Quantity    Description  
p395.x the x-component of the atom position
p395.y the y-component of the atom position
p395.z the z-component of the atom positionp396: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=396
The POSITION action with label p396 calculates the following quantities: Quantity    Description  
p396.x the x-component of the atom position
p396.y the y-component of the atom position
p396.z the z-component of the atom positionp397: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=397
The POSITION action with label p397 calculates the following quantities: Quantity    Description  
p397.x the x-component of the atom position
p397.y the y-component of the atom position
p397.z the z-component of the atom positionp398: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=398
The POSITION action with label p398 calculates the following quantities: Quantity    Description  
p398.x the x-component of the atom position
p398.y the y-component of the atom position
p398.z the z-component of the atom positionp399: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=399
The POSITION action with label p399 calculates the following quantities: Quantity    Description  
p399.x the x-component of the atom position
p399.y the y-component of the atom position
p399.z the z-component of the atom positionp400: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=400
The POSITION action with label p400 calculates the following quantities: Quantity    Description  
p400.x the x-component of the atom position
p400.y the y-component of the atom position
p400.z the z-component of the atom positionp401: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=401
The POSITION action with label p401 calculates the following quantities: Quantity    Description  
p401.x the x-component of the atom position
p401.y the y-component of the atom position
p401.z the z-component of the atom positionp402: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=402
The POSITION action with label p402 calculates the following quantities: Quantity    Description  
p402.x the x-component of the atom position
p402.y the y-component of the atom position
p402.z the z-component of the atom positionp403: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=403
The POSITION action with label p403 calculates the following quantities: Quantity    Description  
p403.x the x-component of the atom position
p403.y the y-component of the atom position
p403.z the z-component of the atom positionp404: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=404
The POSITION action with label p404 calculates the following quantities: Quantity    Description  
p404.x the x-component of the atom position
p404.y the y-component of the atom position
p404.z the z-component of the atom positionp405: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=405
The POSITION action with label p405 calculates the following quantities: Quantity    Description  
p405.x the x-component of the atom position
p405.y the y-component of the atom position
p405.z the z-component of the atom positionp406: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=406
The POSITION action with label p406 calculates the following quantities: Quantity    Description  
p406.x the x-component of the atom position
p406.y the y-component of the atom position
p406.z the z-component of the atom positionp407: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=407
The POSITION action with label p407 calculates the following quantities: Quantity    Description  
p407.x the x-component of the atom position
p407.y the y-component of the atom position
p407.z the z-component of the atom positionp408: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=408
The POSITION action with label p408 calculates the following quantities: Quantity    Description  
p408.x the x-component of the atom position
p408.y the y-component of the atom position
p408.z the z-component of the atom positionp409: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=409
The POSITION action with label p409 calculates the following quantities: Quantity    Description  
p409.x the x-component of the atom position
p409.y the y-component of the atom position
p409.z the z-component of the atom positionp410: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=410
The POSITION action with label p410 calculates the following quantities: Quantity    Description  
p410.x the x-component of the atom position
p410.y the y-component of the atom position
p410.z the z-component of the atom positionp411: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=411
The POSITION action with label p411 calculates the following quantities: Quantity    Description  
p411.x the x-component of the atom position
p411.y the y-component of the atom position
p411.z the z-component of the atom positionp412: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=412
The POSITION action with label p412 calculates the following quantities: Quantity    Description  
p412.x the x-component of the atom position
p412.y the y-component of the atom position
p412.z the z-component of the atom positionp413: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=413
The POSITION action with label p413 calculates the following quantities: Quantity    Description  
p413.x the x-component of the atom position
p413.y the y-component of the atom position
p413.z the z-component of the atom positionp414: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=414
The POSITION action with label p414 calculates the following quantities: Quantity    Description  
p414.x the x-component of the atom position
p414.y the y-component of the atom position
p414.z the z-component of the atom positionp415: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=415
The POSITION action with label p415 calculates the following quantities: Quantity    Description  
p415.x the x-component of the atom position
p415.y the y-component of the atom position
p415.z the z-component of the atom positionp416: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=416
The POSITION action with label p416 calculates the following quantities: Quantity    Description  
p416.x the x-component of the atom position
p416.y the y-component of the atom position
p416.z the z-component of the atom positionp417: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=417
The POSITION action with label p417 calculates the following quantities: Quantity    Description  
p417.x the x-component of the atom position
p417.y the y-component of the atom position
p417.z the z-component of the atom positionp418: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=418
The POSITION action with label p418 calculates the following quantities: Quantity    Description  
p418.x the x-component of the atom position
p418.y the y-component of the atom position
p418.z the z-component of the atom positionp419: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=419
The POSITION action with label p419 calculates the following quantities: Quantity    Description  
p419.x the x-component of the atom position
p419.y the y-component of the atom position
p419.z the z-component of the atom positionp420: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=420
The POSITION action with label p420 calculates the following quantities: Quantity    Description  
p420.x the x-component of the atom position
p420.y the y-component of the atom position
p420.z the z-component of the atom positionp421: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=421
The POSITION action with label p421 calculates the following quantities: Quantity    Description  
p421.x the x-component of the atom position
p421.y the y-component of the atom position
p421.z the z-component of the atom positionp422: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=422
The POSITION action with label p422 calculates the following quantities: Quantity    Description  
p422.x the x-component of the atom position
p422.y the y-component of the atom position
p422.z the z-component of the atom positionp423: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=423
The POSITION action with label p423 calculates the following quantities: Quantity    Description  
p423.x the x-component of the atom position
p423.y the y-component of the atom position
p423.z the z-component of the atom positionp424: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=424
The POSITION action with label p424 calculates the following quantities: Quantity    Description  
p424.x the x-component of the atom position
p424.y the y-component of the atom position
p424.z the z-component of the atom positionp425: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=425
The POSITION action with label p425 calculates the following quantities: Quantity    Description  
p425.x the x-component of the atom position
p425.y the y-component of the atom position
p425.z the z-component of the atom positionp426: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=426
The POSITION action with label p426 calculates the following quantities: Quantity    Description  
p426.x the x-component of the atom position
p426.y the y-component of the atom position
p426.z the z-component of the atom positionp427: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=427
The POSITION action with label p427 calculates the following quantities: Quantity    Description  
p427.x the x-component of the atom position
p427.y the y-component of the atom position
p427.z the z-component of the atom positionp428: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=428
The POSITION action with label p428 calculates the following quantities: Quantity    Description  
p428.x the x-component of the atom position
p428.y the y-component of the atom position
p428.z the z-component of the atom positionp429: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=429
The POSITION action with label p429 calculates the following quantities: Quantity    Description  
p429.x the x-component of the atom position
p429.y the y-component of the atom position
p429.z the z-component of the atom positionp430: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=430
The POSITION action with label p430 calculates the following quantities: Quantity    Description  
p430.x the x-component of the atom position
p430.y the y-component of the atom position
p430.z the z-component of the atom positionp431: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=431
The POSITION action with label p431 calculates the following quantities: Quantity    Description  
p431.x the x-component of the atom position
p431.y the y-component of the atom position
p431.z the z-component of the atom positionp432: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=432
The POSITION action with label p432 calculates the following quantities: Quantity    Description  
p432.x the x-component of the atom position
p432.y the y-component of the atom position
p432.z the z-component of the atom positionp433: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=433
The POSITION action with label p433 calculates the following quantities: Quantity    Description  
p433.x the x-component of the atom position
p433.y the y-component of the atom position
p433.z the z-component of the atom positionp434: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=434
The POSITION action with label p434 calculates the following quantities: Quantity    Description  
p434.x the x-component of the atom position
p434.y the y-component of the atom position
p434.z the z-component of the atom positionp435: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=435
The POSITION action with label p435 calculates the following quantities: Quantity    Description  
p435.x the x-component of the atom position
p435.y the y-component of the atom position
p435.z the z-component of the atom positionp436: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=436
The POSITION action with label p436 calculates the following quantities: Quantity    Description  
p436.x the x-component of the atom position
p436.y the y-component of the atom position
p436.z the z-component of the atom positionp437: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=437
The POSITION action with label p437 calculates the following quantities: Quantity    Description  
p437.x the x-component of the atom position
p437.y the y-component of the atom position
p437.z the z-component of the atom positionp438: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=438
The POSITION action with label p438 calculates the following quantities: Quantity    Description  
p438.x the x-component of the atom position
p438.y the y-component of the atom position
p438.z the z-component of the atom positionp439: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=439
The POSITION action with label p439 calculates the following quantities: Quantity    Description  
p439.x the x-component of the atom position
p439.y the y-component of the atom position
p439.z the z-component of the atom positionp440: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=440
The POSITION action with label p440 calculates the following quantities: Quantity    Description  
p440.x the x-component of the atom position
p440.y the y-component of the atom position
p440.z the z-component of the atom positionp441: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=441
The POSITION action with label p441 calculates the following quantities: Quantity    Description  
p441.x the x-component of the atom position
p441.y the y-component of the atom position
p441.z the z-component of the atom positionp442: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=442
The POSITION action with label p442 calculates the following quantities: Quantity    Description  
p442.x the x-component of the atom position
p442.y the y-component of the atom position
p442.z the z-component of the atom positionp443: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=443
The POSITION action with label p443 calculates the following quantities: Quantity    Description  
p443.x the x-component of the atom position
p443.y the y-component of the atom position
p443.z the z-component of the atom positionp444: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=444
The POSITION action with label p444 calculates the following quantities: Quantity    Description  
p444.x the x-component of the atom position
p444.y the y-component of the atom position
p444.z the z-component of the atom positionp445: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=445
The POSITION action with label p445 calculates the following quantities: Quantity    Description  
p445.x the x-component of the atom position
p445.y the y-component of the atom position
p445.z the z-component of the atom positionp446: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=446
The POSITION action with label p446 calculates the following quantities: Quantity    Description  
p446.x the x-component of the atom position
p446.y the y-component of the atom position
p446.z the z-component of the atom positionp447: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=447
The POSITION action with label p447 calculates the following quantities: Quantity    Description  
p447.x the x-component of the atom position
p447.y the y-component of the atom position
p447.z the z-component of the atom positionp448: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=448
The POSITION action with label p448 calculates the following quantities: Quantity    Description  
p448.x the x-component of the atom position
p448.y the y-component of the atom position
p448.z the z-component of the atom positionp449: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=449
The POSITION action with label p449 calculates the following quantities: Quantity    Description  
p449.x the x-component of the atom position
p449.y the y-component of the atom position
p449.z the z-component of the atom positionp450: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=450
The POSITION action with label p450 calculates the following quantities: Quantity    Description  
p450.x the x-component of the atom position
p450.y the y-component of the atom position
p450.z the z-component of the atom positionp451: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=451
The POSITION action with label p451 calculates the following quantities: Quantity    Description  
p451.x the x-component of the atom position
p451.y the y-component of the atom position
p451.z the z-component of the atom positionp452: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=452
The POSITION action with label p452 calculates the following quantities: Quantity    Description  
p452.x the x-component of the atom position
p452.y the y-component of the atom position
p452.z the z-component of the atom positionp453: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=453
The POSITION action with label p453 calculates the following quantities: Quantity    Description  
p453.x the x-component of the atom position
p453.y the y-component of the atom position
p453.z the z-component of the atom positionp454: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=454
The POSITION action with label p454 calculates the following quantities: Quantity    Description  
p454.x the x-component of the atom position
p454.y the y-component of the atom position
p454.z the z-component of the atom positionp455: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=455
The POSITION action with label p455 calculates the following quantities: Quantity    Description  
p455.x the x-component of the atom position
p455.y the y-component of the atom position
p455.z the z-component of the atom positionp456: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=456
The POSITION action with label p456 calculates the following quantities: Quantity    Description  
p456.x the x-component of the atom position
p456.y the y-component of the atom position
p456.z the z-component of the atom positionp457: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=457
The POSITION action with label p457 calculates the following quantities: Quantity    Description  
p457.x the x-component of the atom position
p457.y the y-component of the atom position
p457.z the z-component of the atom positionp458: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=458
The POSITION action with label p458 calculates the following quantities: Quantity    Description  
p458.x the x-component of the atom position
p458.y the y-component of the atom position
p458.z the z-component of the atom positionp459: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=459
The POSITION action with label p459 calculates the following quantities: Quantity    Description  
p459.x the x-component of the atom position
p459.y the y-component of the atom position
p459.z the z-component of the atom positionp460: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=460
The POSITION action with label p460 calculates the following quantities: Quantity    Description  
p460.x the x-component of the atom position
p460.y the y-component of the atom position
p460.z the z-component of the atom positionp461: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=461
The POSITION action with label p461 calculates the following quantities: Quantity    Description  
p461.x the x-component of the atom position
p461.y the y-component of the atom position
p461.z the z-component of the atom positionp462: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=462
The POSITION action with label p462 calculates the following quantities: Quantity    Description  
p462.x the x-component of the atom position
p462.y the y-component of the atom position
p462.z the z-component of the atom positionp463: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=463
The POSITION action with label p463 calculates the following quantities: Quantity    Description  
p463.x the x-component of the atom position
p463.y the y-component of the atom position
p463.z the z-component of the atom positionp464: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=464
The POSITION action with label p464 calculates the following quantities: Quantity    Description  
p464.x the x-component of the atom position
p464.y the y-component of the atom position
p464.z the z-component of the atom positionp465: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=465
The POSITION action with label p465 calculates the following quantities: Quantity    Description  
p465.x the x-component of the atom position
p465.y the y-component of the atom position
p465.z the z-component of the atom positionp466: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=466
The POSITION action with label p466 calculates the following quantities: Quantity    Description  
p466.x the x-component of the atom position
p466.y the y-component of the atom position
p466.z the z-component of the atom positionp467: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=467
The POSITION action with label p467 calculates the following quantities: Quantity    Description  
p467.x the x-component of the atom position
p467.y the y-component of the atom position
p467.z the z-component of the atom positionp468: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=468
The POSITION action with label p468 calculates the following quantities: Quantity    Description  
p468.x the x-component of the atom position
p468.y the y-component of the atom position
p468.z the z-component of the atom positionp469: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=469
The POSITION action with label p469 calculates the following quantities: Quantity    Description  
p469.x the x-component of the atom position
p469.y the y-component of the atom position
p469.z the z-component of the atom positionp470: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=470
The POSITION action with label p470 calculates the following quantities: Quantity    Description  
p470.x the x-component of the atom position
p470.y the y-component of the atom position
p470.z the z-component of the atom positionp471: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=471
The POSITION action with label p471 calculates the following quantities: Quantity    Description  
p471.x the x-component of the atom position
p471.y the y-component of the atom position
p471.z the z-component of the atom positionp472: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=472
The POSITION action with label p472 calculates the following quantities: Quantity    Description  
p472.x the x-component of the atom position
p472.y the y-component of the atom position
p472.z the z-component of the atom positionp473: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=473
The POSITION action with label p473 calculates the following quantities: Quantity    Description  
p473.x the x-component of the atom position
p473.y the y-component of the atom position
p473.z the z-component of the atom positionp474: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=474
The POSITION action with label p474 calculates the following quantities: Quantity    Description  
p474.x the x-component of the atom position
p474.y the y-component of the atom position
p474.z the z-component of the atom positionp475: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=475
The POSITION action with label p475 calculates the following quantities: Quantity    Description  
p475.x the x-component of the atom position
p475.y the y-component of the atom position
p475.z the z-component of the atom positionp476: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=476
The POSITION action with label p476 calculates the following quantities: Quantity    Description  
p476.x the x-component of the atom position
p476.y the y-component of the atom position
p476.z the z-component of the atom positionp477: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=477
The POSITION action with label p477 calculates the following quantities: Quantity    Description  
p477.x the x-component of the atom position
p477.y the y-component of the atom position
p477.z the z-component of the atom positionp478: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=478
The POSITION action with label p478 calculates the following quantities: Quantity    Description  
p478.x the x-component of the atom position
p478.y the y-component of the atom position
p478.z the z-component of the atom positionp479: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=479
The POSITION action with label p479 calculates the following quantities: Quantity    Description  
p479.x the x-component of the atom position
p479.y the y-component of the atom position
p479.z the z-component of the atom positionp480: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=480
The POSITION action with label p480 calculates the following quantities: Quantity    Description  
p480.x the x-component of the atom position
p480.y the y-component of the atom position
p480.z the z-component of the atom positionp481: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=481
The POSITION action with label p481 calculates the following quantities: Quantity    Description  
p481.x the x-component of the atom position
p481.y the y-component of the atom position
p481.z the z-component of the atom positionp482: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=482
The POSITION action with label p482 calculates the following quantities: Quantity    Description  
p482.x the x-component of the atom position
p482.y the y-component of the atom position
p482.z the z-component of the atom positionp483: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=483
The POSITION action with label p483 calculates the following quantities: Quantity    Description  
p483.x the x-component of the atom position
p483.y the y-component of the atom position
p483.z the z-component of the atom positionp484: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=484
The POSITION action with label p484 calculates the following quantities: Quantity    Description  
p484.x the x-component of the atom position
p484.y the y-component of the atom position
p484.z the z-component of the atom positionp485: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=485
The POSITION action with label p485 calculates the following quantities: Quantity    Description  
p485.x the x-component of the atom position
p485.y the y-component of the atom position
p485.z the z-component of the atom positionp486: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=486
The POSITION action with label p486 calculates the following quantities: Quantity    Description  
p486.x the x-component of the atom position
p486.y the y-component of the atom position
p486.z the z-component of the atom positionp487: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=487
The POSITION action with label p487 calculates the following quantities: Quantity    Description  
p487.x the x-component of the atom position
p487.y the y-component of the atom position
p487.z the z-component of the atom positionp488: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=488
The POSITION action with label p488 calculates the following quantities: Quantity    Description  
p488.x the x-component of the atom position
p488.y the y-component of the atom position
p488.z the z-component of the atom positionp489: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=489
The POSITION action with label p489 calculates the following quantities: Quantity    Description  
p489.x the x-component of the atom position
p489.y the y-component of the atom position
p489.z the z-component of the atom positionp490: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=490
The POSITION action with label p490 calculates the following quantities: Quantity    Description  
p490.x the x-component of the atom position
p490.y the y-component of the atom position
p490.z the z-component of the atom positionp491: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=491
The POSITION action with label p491 calculates the following quantities: Quantity    Description  
p491.x the x-component of the atom position
p491.y the y-component of the atom position
p491.z the z-component of the atom positionp492: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=492
The POSITION action with label p492 calculates the following quantities: Quantity    Description  
p492.x the x-component of the atom position
p492.y the y-component of the atom position
p492.z the z-component of the atom positionp493: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=493
The POSITION action with label p493 calculates the following quantities: Quantity    Description  
p493.x the x-component of the atom position
p493.y the y-component of the atom position
p493.z the z-component of the atom positionp494: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=494
The POSITION action with label p494 calculates the following quantities: Quantity    Description  
p494.x the x-component of the atom position
p494.y the y-component of the atom position
p494.z the z-component of the atom positionp495: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=495
The POSITION action with label p495 calculates the following quantities: Quantity    Description  
p495.x the x-component of the atom position
p495.y the y-component of the atom position
p495.z the z-component of the atom positionp496: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=496
The POSITION action with label p496 calculates the following quantities: Quantity    Description  
p496.x the x-component of the atom position
p496.y the y-component of the atom position
p496.z the z-component of the atom positionp497: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=497
The POSITION action with label p497 calculates the following quantities: Quantity    Description  
p497.x the x-component of the atom position
p497.y the y-component of the atom position
p497.z the z-component of the atom positionp498: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=498
The POSITION action with label p498 calculates the following quantities: Quantity    Description  
p498.x the x-component of the atom position
p498.y the y-component of the atom position
p498.z the z-component of the atom positionp499: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=499
The POSITION action with label p499 calculates the following quantities: Quantity    Description  
p499.x the x-component of the atom position
p499.y the y-component of the atom position
p499.z the z-component of the atom positionp500: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=500
The POSITION action with label p500 calculates the following quantities: Quantity    Description  
p500.x the x-component of the atom position
p500.y the y-component of the atom position
p500.z the z-component of the atom positionp501: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=501
The POSITION action with label p501 calculates the following quantities: Quantity    Description  
p501.x the x-component of the atom position
p501.y the y-component of the atom position
p501.z the z-component of the atom positionp502: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=502
The POSITION action with label p502 calculates the following quantities: Quantity    Description  
p502.x the x-component of the atom position
p502.y the y-component of the atom position
p502.z the z-component of the atom positionp503: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=503
The POSITION action with label p503 calculates the following quantities: Quantity    Description  
p503.x the x-component of the atom position
p503.y the y-component of the atom position
p503.z the z-component of the atom positionp504: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=504
The POSITION action with label p504 calculates the following quantities: Quantity    Description  
p504.x the x-component of the atom position
p504.y the y-component of the atom position
p504.z the z-component of the atom positionp505: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=505
The POSITION action with label p505 calculates the following quantities: Quantity    Description  
p505.x the x-component of the atom position
p505.y the y-component of the atom position
p505.z the z-component of the atom positionp506: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=506
The POSITION action with label p506 calculates the following quantities: Quantity    Description  
p506.x the x-component of the atom position
p506.y the y-component of the atom position
p506.z the z-component of the atom positionp507: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=507
The POSITION action with label p507 calculates the following quantities: Quantity    Description  
p507.x the x-component of the atom position
p507.y the y-component of the atom position
p507.z the z-component of the atom positionp508: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=508
The POSITION action with label p508 calculates the following quantities: Quantity    Description  
p508.x the x-component of the atom position
p508.y the y-component of the atom position
p508.z the z-component of the atom positionp509: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=509
The POSITION action with label p509 calculates the following quantities: Quantity    Description  
p509.x the x-component of the atom position
p509.y the y-component of the atom position
p509.z the z-component of the atom positionp510: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=510
The POSITION action with label p510 calculates the following quantities: Quantity    Description  
p510.x the x-component of the atom position
p510.y the y-component of the atom position
p510.z the z-component of the atom positionp511: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=511
The POSITION action with label p511 calculates the following quantities: Quantity    Description  
p511.x the x-component of the atom position
p511.y the y-component of the atom position
p511.z the z-component of the atom positionp512: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=512
The POSITION action with label p512 calculates the following quantities: Quantity    Description  
p512.x the x-component of the atom position
p512.y the y-component of the atom position
p512.z the z-component of the atom positionp513: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=513
The POSITION action with label p513 calculates the following quantities: Quantity    Description  
p513.x the x-component of the atom position
p513.y the y-component of the atom position
p513.z the z-component of the atom positionp514: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=514
The POSITION action with label p514 calculates the following quantities: Quantity    Description  
p514.x the x-component of the atom position
p514.y the y-component of the atom position
p514.z the z-component of the atom positionp515: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=515
The POSITION action with label p515 calculates the following quantities: Quantity    Description  
p515.x the x-component of the atom position
p515.y the y-component of the atom position
p515.z the z-component of the atom positionp516: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=516
The POSITION action with label p516 calculates the following quantities: Quantity    Description  
p516.x the x-component of the atom position
p516.y the y-component of the atom position
p516.z the z-component of the atom positionp517: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=517
The POSITION action with label p517 calculates the following quantities: Quantity    Description  
p517.x the x-component of the atom position
p517.y the y-component of the atom position
p517.z the z-component of the atom positionp518: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=518
The POSITION action with label p518 calculates the following quantities: Quantity    Description  
p518.x the x-component of the atom position
p518.y the y-component of the atom position
p518.z the z-component of the atom positionp519: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=519
The POSITION action with label p519 calculates the following quantities: Quantity    Description  
p519.x the x-component of the atom position
p519.y the y-component of the atom position
p519.z the z-component of the atom positionp520: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=520
The POSITION action with label p520 calculates the following quantities: Quantity    Description  
p520.x the x-component of the atom position
p520.y the y-component of the atom position
p520.z the z-component of the atom positionp521: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=521
The POSITION action with label p521 calculates the following quantities: Quantity    Description  
p521.x the x-component of the atom position
p521.y the y-component of the atom position
p521.z the z-component of the atom positionp522: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=522
The POSITION action with label p522 calculates the following quantities: Quantity    Description  
p522.x the x-component of the atom position
p522.y the y-component of the atom position
p522.z the z-component of the atom positionp523: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=523
The POSITION action with label p523 calculates the following quantities: Quantity    Description  
p523.x the x-component of the atom position
p523.y the y-component of the atom position
p523.z the z-component of the atom positionp524: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=524
The POSITION action with label p524 calculates the following quantities: Quantity    Description  
p524.x the x-component of the atom position
p524.y the y-component of the atom position
p524.z the z-component of the atom positionp525: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=525
The POSITION action with label p525 calculates the following quantities: Quantity    Description  
p525.x the x-component of the atom position
p525.y the y-component of the atom position
p525.z the z-component of the atom positionp526: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=526
The POSITION action with label p526 calculates the following quantities: Quantity    Description  
p526.x the x-component of the atom position
p526.y the y-component of the atom position
p526.z the z-component of the atom positionp527: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=527
The POSITION action with label p527 calculates the following quantities: Quantity    Description  
p527.x the x-component of the atom position
p527.y the y-component of the atom position
p527.z the z-component of the atom positionp528: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=528
The POSITION action with label p528 calculates the following quantities: Quantity    Description  
p528.x the x-component of the atom position
p528.y the y-component of the atom position
p528.z the z-component of the atom positionp529: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=529
The POSITION action with label p529 calculates the following quantities: Quantity    Description  
p529.x the x-component of the atom position
p529.y the y-component of the atom position
p529.z the z-component of the atom positionp530: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=530
The POSITION action with label p530 calculates the following quantities: Quantity    Description  
p530.x the x-component of the atom position
p530.y the y-component of the atom position
p530.z the z-component of the atom positionp531: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=531
The POSITION action with label p531 calculates the following quantities: Quantity    Description  
p531.x the x-component of the atom position
p531.y the y-component of the atom position
p531.z the z-component of the atom positionp532: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=532
The POSITION action with label p532 calculates the following quantities: Quantity    Description  
p532.x the x-component of the atom position
p532.y the y-component of the atom position
p532.z the z-component of the atom positionp533: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=533
The POSITION action with label p533 calculates the following quantities: Quantity    Description  
p533.x the x-component of the atom position
p533.y the y-component of the atom position
p533.z the z-component of the atom positionp534: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=534
The POSITION action with label p534 calculates the following quantities: Quantity    Description  
p534.x the x-component of the atom position
p534.y the y-component of the atom position
p534.z the z-component of the atom positionp535: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=535
The POSITION action with label p535 calculates the following quantities: Quantity    Description  
p535.x the x-component of the atom position
p535.y the y-component of the atom position
p535.z the z-component of the atom positionp536: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=536
The POSITION action with label p536 calculates the following quantities: Quantity    Description  
p536.x the x-component of the atom position
p536.y the y-component of the atom position
p536.z the z-component of the atom positionp537: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=537
The POSITION action with label p537 calculates the following quantities: Quantity    Description  
p537.x the x-component of the atom position
p537.y the y-component of the atom position
p537.z the z-component of the atom positionp538: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=538
The POSITION action with label p538 calculates the following quantities: Quantity    Description  
p538.x the x-component of the atom position
p538.y the y-component of the atom position
p538.z the z-component of the atom positionp539: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=539
The POSITION action with label p539 calculates the following quantities: Quantity    Description  
p539.x the x-component of the atom position
p539.y the y-component of the atom position
p539.z the z-component of the atom positionp540: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=540
The POSITION action with label p540 calculates the following quantities: Quantity    Description  
p540.x the x-component of the atom position
p540.y the y-component of the atom position
p540.z the z-component of the atom positionp541: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=541
The POSITION action with label p541 calculates the following quantities: Quantity    Description  
p541.x the x-component of the atom position
p541.y the y-component of the atom position
p541.z the z-component of the atom positionp542: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=542
The POSITION action with label p542 calculates the following quantities: Quantity    Description  
p542.x the x-component of the atom position
p542.y the y-component of the atom position
p542.z the z-component of the atom positionp543: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=543
The POSITION action with label p543 calculates the following quantities: Quantity    Description  
p543.x the x-component of the atom position
p543.y the y-component of the atom position
p543.z the z-component of the atom positionp544: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=544
The POSITION action with label p544 calculates the following quantities: Quantity    Description  
p544.x the x-component of the atom position
p544.y the y-component of the atom position
p544.z the z-component of the atom positionp545: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=545
The POSITION action with label p545 calculates the following quantities: Quantity    Description  
p545.x the x-component of the atom position
p545.y the y-component of the atom position
p545.z the z-component of the atom positionp546: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=546
The POSITION action with label p546 calculates the following quantities: Quantity    Description  
p546.x the x-component of the atom position
p546.y the y-component of the atom position
p546.z the z-component of the atom positionp547: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=547
The POSITION action with label p547 calculates the following quantities: Quantity    Description  
p547.x the x-component of the atom position
p547.y the y-component of the atom position
p547.z the z-component of the atom positionp548: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=548
The POSITION action with label p548 calculates the following quantities: Quantity    Description  
p548.x the x-component of the atom position
p548.y the y-component of the atom position
p548.z the z-component of the atom positionp549: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=549
The POSITION action with label p549 calculates the following quantities: Quantity    Description  
p549.x the x-component of the atom position
p549.y the y-component of the atom position
p549.z the z-component of the atom positionp550: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=550
The POSITION action with label p550 calculates the following quantities: Quantity    Description  
p550.x the x-component of the atom position
p550.y the y-component of the atom position
p550.z the z-component of the atom positionp551: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=551
The POSITION action with label p551 calculates the following quantities: Quantity    Description  
p551.x the x-component of the atom position
p551.y the y-component of the atom position
p551.z the z-component of the atom positionp552: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=552
The POSITION action with label p552 calculates the following quantities: Quantity    Description  
p552.x the x-component of the atom position
p552.y the y-component of the atom position
p552.z the z-component of the atom positionp553: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=553
The POSITION action with label p553 calculates the following quantities: Quantity    Description  
p553.x the x-component of the atom position
p553.y the y-component of the atom position
p553.z the z-component of the atom positionp554: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=554
The POSITION action with label p554 calculates the following quantities: Quantity    Description  
p554.x the x-component of the atom position
p554.y the y-component of the atom position
p554.z the z-component of the atom positionp555: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=555
The POSITION action with label p555 calculates the following quantities: Quantity    Description  
p555.x the x-component of the atom position
p555.y the y-component of the atom position
p555.z the z-component of the atom positionp556: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=556
The POSITION action with label p556 calculates the following quantities: Quantity    Description  
p556.x the x-component of the atom position
p556.y the y-component of the atom position
p556.z the z-component of the atom positionp557: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=557
The POSITION action with label p557 calculates the following quantities: Quantity    Description  
p557.x the x-component of the atom position
p557.y the y-component of the atom position
p557.z the z-component of the atom positionp558: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=558
The POSITION action with label p558 calculates the following quantities: Quantity    Description  
p558.x the x-component of the atom position
p558.y the y-component of the atom position
p558.z the z-component of the atom positionp559: POSITIONCalculate the components of the position of an atom or atoms. More details ATOMthe atom number=559

The POSITION action with label p559 calculates the following quantities: Quantity    Description  
p559.x the x-component of the atom position
p559.y the y-component of the atom position
p559.z the z-component of the atom positioncell: CELLGet the components of the simulation cell More details

The CELL action with label cell calculates the following quantities: Quantity    Description  
cell.ax the ax component of the cell matrix
cell.ay the ay component of the cell matrix
cell.az the az component of the cell matrix
cell.bx the bx component of the cell matrix
cell.by the by component of the cell matrix
cell.bz the bz component of the cell matrix
cell.cx the cx component of the cell matrix
cell.cy the cy component of the cell matrix
cell.cz the cz component of the cell matrixz: PYTORCH_MODEL_BIAS_VERLET_BOXThis action is not part of PLUMED and was included by using a LOAD command More details FILE=../../../iter_0/model_trivial_npt_0.pt ARG=p1.x,p1.y,p1.z,p2.x,p2.y,p2.z,p3.x,p3.y,p3.z,p4.x,p4.y,p4.z,p5.x,p5.y,p5.z,p6.x,p6.y,p6.z,p7.x,p7.y,p7.z,p8.x,p8.y,p8.z,p9.x,p9.y,p9.z,p10.x,p10.y,p10.z,p11.x,p11.y,p11.z,p12.x,p12.y,p12.z,p13.x,p13.y,p13.z,p14.x,p14.y,p14.z,p15.x,p15.y,p15.z,p16.x,p16.y,p16.z,p17.x,p17.y,p17.z,p18.x,p18.y,p18.z,p19.x,p19.y,p19.z,p20.x,p20.y,p20.z,p21.x,p21.y,p21.z,p22.x,p22.y,p22.z,p23.x,p23.y,p23.z,p24.x,p24.y,p24.z,p25.x,p25.y,p25.z,p26.x,p26.y,p26.z,p27.x,p27.y,p27.z,p28.x,p28.y,p28.z,p29.x,p29.y,p29.z,p30.x,p30.y,p30.z,p31.x,p31.y,p31.z,p32.x,p32.y,p32.z,p33.x,p33.y,p33.z,p34.x,p34.y,p34.z,p35.x,p35.y,p35.z,p36.x,p36.y,p36.z,p37.x,p37.y,p37.z,p38.x,p38.y,p38.z,p39.x,p39.y,p39.z,p40.x,p40.y,p40.z,p41.x,p41.y,p41.z,p42.x,p42.y,p42.z,p43.x,p43.y,p43.z,p44.x,p44.y,p44.z,p45.x,p45.y,p45.z,p46.x,p46.y,p46.z,p47.x,p47.y,p47.z,p48.x,p48.y,p48.z,p49.x,p49.y,p49.z,p50.x,p50.y,p50.z,p51.x,p51.y,p51.z,p52.x,p52.y,p52.z,p53.x,p53.y,p53.z,p54.x,p54.y,p54.z,p55.x,p55.y,p55.z,p56.x,p56.y,p56.z,p57.x,p57.y,p57.z,p58.x,p58.y,p58.z,p59.x,p59.y,p59.z,p60.x,p60.y,p60.z,p61.x,p61.y,p61.z,p62.x,p62.y,p62.z,p63.x,p63.y,p63.z,p64.x,p64.y,p64.z,p65.x,p65.y,p65.z,p66.x,p66.y,p66.z,p67.x,p67.y,p67.z,p68.x,p68.y,p68.z,p69.x,p69.y,p69.z,p70.x,p70.y,p70.z,p71.x,p71.y,p71.z,p72.x,p72.y,p72.z,p73.x,p73.y,p73.z,p74.x,p74.y,p74.z,p75.x,p75.y,p75.z,p76.x,p76.y,p76.z,p77.x,p77.y,p77.z,p78.x,p78.y,p78.z,p79.x,p79.y,p79.z,p80.x,p80.y,p80.z,p81.x,p81.y,p81.z,p82.x,p82.y,p82.z,p83.x,p83.y,p83.z,p84.x,p84.y,p84.z,p85.x,p85.y,p85.z,p86.x,p86.y,p86.z,p87.x,p87.y,p87.z,p88.x,p88.y,p88.z,p89.x,p89.y,p89.z,p90.x,p90.y,p90.z,p91.x,p91.y,p91.z,p92.x,p92.y,p92.z,p93.x,p93.y,p93.z,p94.x,p94.y,p94.z,p95.x,p95.y,p95.z,p96.x,p96.y,p96.z,p97.x,p97.y,p97.z,p98.x,p98.y,p98.z,p99.x,p99.y,p99.z,p100.x,p100.y,p100.z,p101.x,p101.y,p101.z,p102.x,p102.y,p102.z,p103.x,p103.y,p103.z,p104.x,p104.y,p104.z,p105.x,p105.y,p105.z,p106.x,p106.y,p106.z,p107.x,p107.y,p107.z,p108.x,p108.y,p108.z,p109.x,p109.y,p109.z,p110.x,p110.y,p110.z,p111.x,p111.y,p111.z,p112.x,p112.y,p112.z,p113.x,p113.y,p113.z,p114.x,p114.y,p114.z,p115.x,p115.y,p115.z,p116.x,p116.y,p116.z,p117.x,p117.y,p117.z,p118.x,p118.y,p118.z,p119.x,p119.y,p119.z,p120.x,p120.y,p120.z,p121.x,p121.y,p121.z,p122.x,p122.y,p122.z,p123.x,p123.y,p123.z,p124.x,p124.y,p124.z,p125.x,p125.y,p125.z,p126.x,p126.y,p126.z,p127.x,p127.y,p127.z,p128.x,p128.y,p128.z,p129.x,p129.y,p129.z,p130.x,p130.y,p130.z,p131.x,p131.y,p131.z,p132.x,p132.y,p132.z,p133.x,p133.y,p133.z,p134.x,p134.y,p134.z,p135.x,p135.y,p135.z,p136.x,p136.y,p136.z,p137.x,p137.y,p137.z,p138.x,p138.y,p138.z,p139.x,p139.y,p139.z,p140.x,p140.y,p140.z,p141.x,p141.y,p141.z,p142.x,p142.y,p142.z,p143.x,p143.y,p143.z,p144.x,p144.y,p144.z,p145.x,p145.y,p145.z,p146.x,p146.y,p146.z,p147.x,p147.y,p147.z,p148.x,p148.y,p148.z,p149.x,p149.y,p149.z,p150.x,p150.y,p150.z,p151.x,p151.y,p151.z,p152.x,p152.y,p152.z,p153.x,p153.y,p153.z,p154.x,p154.y,p154.z,p155.x,p155.y,p155.z,p156.x,p156.y,p156.z,p157.x,p157.y,p157.z,p158.x,p158.y,p158.z,p159.x,p159.y,p159.z,p160.x,p160.y,p160.z,p161.x,p161.y,p161.z,p162.x,p162.y,p162.z,p163.x,p163.y,p163.z,p164.x,p164.y,p164.z,p165.x,p165.y,p165.z,p166.x,p166.y,p166.z,p167.x,p167.y,p167.z,p168.x,p168.y,p168.z,p169.x,p169.y,p169.z,p170.x,p170.y,p170.z,p171.x,p171.y,p171.z,p172.x,p172.y,p172.z,p173.x,p173.y,p173.z,p174.x,p174.y,p174.z,p175.x,p175.y,p175.z,p176.x,p176.y,p176.z,p177.x,p177.y,p177.z,p178.x,p178.y,p178.z,p179.x,p179.y,p179.z,p180.x,p180.y,p180.z,p181.x,p181.y,p181.z,p182.x,p182.y,p182.z,p183.x,p183.y,p183.z,p184.x,p184.y,p184.z,p185.x,p185.y,p185.z,p186.x,p186.y,p186.z,p187.x,p187.y,p187.z,p188.x,p188.y,p188.z,p189.x,p189.y,p189.z,p190.x,p190.y,p190.z,p191.x,p191.y,p191.z,p192.x,p192.y,p192.z,p193.x,p193.y,p193.z,p194.x,p194.y,p194.z,p195.x,p195.y,p195.z,p196.x,p196.y,p196.z,p197.x,p197.y,p197.z,p198.x,p198.y,p198.z,p199.x,p199.y,p199.z,p200.x,p200.y,p200.z,p201.x,p201.y,p201.z,p202.x,p202.y,p202.z,p203.x,p203.y,p203.z,p204.x,p204.y,p204.z,p205.x,p205.y,p205.z,p206.x,p206.y,p206.z,p207.x,p207.y,p207.z,p208.x,p208.y,p208.z,p209.x,p209.y,p209.z,p210.x,p210.y,p210.z,p211.x,p211.y,p211.z,p212.x,p212.y,p212.z,p213.x,p213.y,p213.z,p214.x,p214.y,p214.z,p215.x,p215.y,p215.z,p216.x,p216.y,p216.z,p217.x,p217.y,p217.z,p218.x,p218.y,p218.z,p219.x,p219.y,p219.z,p220.x,p220.y,p220.z,p221.x,p221.y,p221.z,p222.x,p222.y,p222.z,p223.x,p223.y,p223.z,p224.x,p224.y,p224.z,p225.x,p225.y,p225.z,p226.x,p226.y,p226.z,p227.x,p227.y,p227.z,p228.x,p228.y,p228.z,p229.x,p229.y,p229.z,p230.x,p230.y,p230.z,p231.x,p231.y,p231.z,p232.x,p232.y,p232.z,p233.x,p233.y,p233.z,p234.x,p234.y,p234.z,p235.x,p235.y,p235.z,p236.x,p236.y,p236.z,p237.x,p237.y,p237.z,p238.x,p238.y,p238.z,p239.x,p239.y,p239.z,p240.x,p240.y,p240.z,p241.x,p241.y,p241.z,p242.x,p242.y,p242.z,p243.x,p243.y,p243.z,p244.x,p244.y,p244.z,p245.x,p245.y,p245.z,p246.x,p246.y,p246.z,p247.x,p247.y,p247.z,p248.x,p248.y,p248.z,p249.x,p249.y,p249.z,p250.x,p250.y,p250.z,p251.x,p251.y,p251.z,p252.x,p252.y,p252.z,p253.x,p253.y,p253.z,p254.x,p254.y,p254.z,p255.x,p255.y,p255.z,p256.x,p256.y,p256.z,p257.x,p257.y,p257.z,p258.x,p258.y,p258.z,p259.x,p259.y,p259.z,p260.x,p260.y,p260.z,p261.x,p261.y,p261.z,p262.x,p262.y,p262.z,p263.x,p263.y,p263.z,p264.x,p264.y,p264.z,p265.x,p265.y,p265.z,p266.x,p266.y,p266.z,p267.x,p267.y,p267.z,p268.x,p268.y,p268.z,p269.x,p269.y,p269.z,p270.x,p270.y,p270.z,p271.x,p271.y,p271.z,p272.x,p272.y,p272.z,p273.x,p273.y,p273.z,p274.x,p274.y,p274.z,p275.x,p275.y,p275.z,p276.x,p276.y,p276.z,p277.x,p277.y,p277.z,p278.x,p278.y,p278.z,p279.x,p279.y,p279.z,p280.x,p280.y,p280.z,p281.x,p281.y,p281.z,p282.x,p282.y,p282.z,p283.x,p283.y,p283.z,p284.x,p284.y,p284.z,p285.x,p285.y,p285.z,p286.x,p286.y,p286.z,p287.x,p287.y,p287.z,p288.x,p288.y,p288.z,p289.x,p289.y,p289.z,p290.x,p290.y,p290.z,p291.x,p291.y,p291.z,p292.x,p292.y,p292.z,p293.x,p293.y,p293.z,p294.x,p294.y,p294.z,p295.x,p295.y,p295.z,p296.x,p296.y,p296.z,p297.x,p297.y,p297.z,p298.x,p298.y,p298.z,p299.x,p299.y,p299.z,p300.x,p300.y,p300.z,p301.x,p301.y,p301.z,p302.x,p302.y,p302.z,p303.x,p303.y,p303.z,p304.x,p304.y,p304.z,p305.x,p305.y,p305.z,p306.x,p306.y,p306.z,p307.x,p307.y,p307.z,p308.x,p308.y,p308.z,p309.x,p309.y,p309.z,p310.x,p310.y,p310.z,p311.x,p311.y,p311.z,p312.x,p312.y,p312.z,p313.x,p313.y,p313.z,p314.x,p314.y,p314.z,p315.x,p315.y,p315.z,p316.x,p316.y,p316.z,p317.x,p317.y,p317.z,p318.x,p318.y,p318.z,p319.x,p319.y,p319.z,p320.x,p320.y,p320.z,p321.x,p321.y,p321.z,p322.x,p322.y,p322.z,p323.x,p323.y,p323.z,p324.x,p324.y,p324.z,p325.x,p325.y,p325.z,p326.x,p326.y,p326.z,p327.x,p327.y,p327.z,p328.x,p328.y,p328.z,p329.x,p329.y,p329.z,p330.x,p330.y,p330.z,p331.x,p331.y,p331.z,p332.x,p332.y,p332.z,p333.x,p333.y,p333.z,p334.x,p334.y,p334.z,p335.x,p335.y,p335.z,p336.x,p336.y,p336.z,p337.x,p337.y,p337.z,p338.x,p338.y,p338.z,p339.x,p339.y,p339.z,p340.x,p340.y,p340.z,p341.x,p341.y,p341.z,p342.x,p342.y,p342.z,p343.x,p343.y,p343.z,p344.x,p344.y,p344.z,p345.x,p345.y,p345.z,p346.x,p346.y,p346.z,p347.x,p347.y,p347.z,p348.x,p348.y,p348.z,p349.x,p349.y,p349.z,p350.x,p350.y,p350.z,p351.x,p351.y,p351.z,p352.x,p352.y,p352.z,p353.x,p353.y,p353.z,p354.x,p354.y,p354.z,p355.x,p355.y,p355.z,p356.x,p356.y,p356.z,p357.x,p357.y,p357.z,p358.x,p358.y,p358.z,p359.x,p359.y,p359.z,p360.x,p360.y,p360.z,p361.x,p361.y,p361.z,p362.x,p362.y,p362.z,p363.x,p363.y,p363.z,p364.x,p364.y,p364.z,p365.x,p365.y,p365.z,p366.x,p366.y,p366.z,p367.x,p367.y,p367.z,p368.x,p368.y,p368.z,p369.x,p369.y,p369.z,p370.x,p370.y,p370.z,p371.x,p371.y,p371.z,p372.x,p372.y,p372.z,p373.x,p373.y,p373.z,p374.x,p374.y,p374.z,p375.x,p375.y,p375.z,p376.x,p376.y,p376.z,p377.x,p377.y,p377.z,p378.x,p378.y,p378.z,p379.x,p379.y,p379.z,p380.x,p380.y,p380.z,p381.x,p381.y,p381.z,p382.x,p382.y,p382.z,p383.x,p383.y,p383.z,p384.x,p384.y,p384.z,p385.x,p385.y,p385.z,p386.x,p386.y,p386.z,p387.x,p387.y,p387.z,p388.x,p388.y,p388.z,p389.x,p389.y,p389.z,p390.x,p390.y,p390.z,p391.x,p391.y,p391.z,p392.x,p392.y,p392.z,p393.x,p393.y,p393.z,p394.x,p394.y,p394.z,p395.x,p395.y,p395.z,p396.x,p396.y,p396.z,p397.x,p397.y,p397.z,p398.x,p398.y,p398.z,p399.x,p399.y,p399.z,p400.x,p400.y,p400.z,p401.x,p401.y,p401.z,p402.x,p402.y,p402.z,p403.x,p403.y,p403.z,p404.x,p404.y,p404.z,p405.x,p405.y,p405.z,p406.x,p406.y,p406.z,p407.x,p407.y,p407.z,p408.x,p408.y,p408.z,p409.x,p409.y,p409.z,p410.x,p410.y,p410.z,p411.x,p411.y,p411.z,p412.x,p412.y,p412.z,p413.x,p413.y,p413.z,p414.x,p414.y,p414.z,p415.x,p415.y,p415.z,p416.x,p416.y,p416.z,p417.x,p417.y,p417.z,p418.x,p418.y,p418.z,p419.x,p419.y,p419.z,p420.x,p420.y,p420.z,p421.x,p421.y,p421.z,p422.x,p422.y,p422.z,p423.x,p423.y,p423.z,p424.x,p424.y,p424.z,p425.x,p425.y,p425.z,p426.x,p426.y,p426.z,p427.x,p427.y,p427.z,p428.x,p428.y,p428.z,p429.x,p429.y,p429.z,p430.x,p430.y,p430.z,p431.x,p431.y,p431.z,p432.x,p432.y,p432.z,p433.x,p433.y,p433.z,p434.x,p434.y,p434.z,p435.x,p435.y,p435.z,p436.x,p436.y,p436.z,p437.x,p437.y,p437.z,p438.x,p438.y,p438.z,p439.x,p439.y,p439.z,p440.x,p440.y,p440.z,p441.x,p441.y,p441.z,p442.x,p442.y,p442.z,p443.x,p443.y,p443.z,p444.x,p444.y,p444.z,p445.x,p445.y,p445.z,p446.x,p446.y,p446.z,p447.x,p447.y,p447.z,p448.x,p448.y,p448.z,p449.x,p449.y,p449.z,p450.x,p450.y,p450.z,p451.x,p451.y,p451.z,p452.x,p452.y,p452.z,p453.x,p453.y,p453.z,p454.x,p454.y,p454.z,p455.x,p455.y,p455.z,p456.x,p456.y,p456.z,p457.x,p457.y,p457.z,p458.x,p458.y,p458.z,p459.x,p459.y,p459.z,p460.x,p460.y,p460.z,p461.x,p461.y,p461.z,p462.x,p462.y,p462.z,p463.x,p463.y,p463.z,p464.x,p464.y,p464.z,p465.x,p465.y,p465.z,p466.x,p466.y,p466.z,p467.x,p467.y,p467.z,p468.x,p468.y,p468.z,p469.x,p469.y,p469.z,p470.x,p470.y,p470.z,p471.x,p471.y,p471.z,p472.x,p472.y,p472.z,p473.x,p473.y,p473.z,p474.x,p474.y,p474.z,p475.x,p475.y,p475.z,p476.x,p476.y,p476.z,p477.x,p477.y,p477.z,p478.x,p478.y,p478.z,p479.x,p479.y,p479.z,p480.x,p480.y,p480.z,p481.x,p481.y,p481.z,p482.x,p482.y,p482.z,p483.x,p483.y,p483.z,p484.x,p484.y,p484.z,p485.x,p485.y,p485.z,p486.x,p486.y,p486.z,p487.x,p487.y,p487.z,p488.x,p488.y,p488.z,p489.x,p489.y,p489.z,p490.x,p490.y,p490.z,p491.x,p491.y,p491.z,p492.x,p4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 LAMBDA=4447 EPSILON=1e-7 NATOMS=559 GRAD_SCALE=10 CUTOFF=3.75 SKIN=1.0 GPU


bias: CUSTOMCalculate a combination of variables using a custom expression. More details ARGthe values input to this function=z.bias-0 varthe names to give each of the arguments in the function=a PERIODICif the output of your function is periodic then you should specify the periodicity of the function=NO FUNCthe function you wish to evaluate=-a-0.00
The CUSTOM action with label bias calculates the following quantities: Quantity    Description  
bias.value an arbitrary functionpotential: BIASVALUETakes the value of one variable and use it as a bias More details ARGthe labels of the scalar/vector arguments whose values will be used as a bias on the system=bias

# OPES bias
The BIASVALUE action with label potential calculates the following quantities: Quantity    Description  
potential.bias the instantaneous value of the bias potential
potential._bias one or multiple instances of this quantity can be referenced elsewhere in the input fileopes: OPES_METAD_EXPLOREOn-the-fly probability enhanced sampling with well-tempered target distribution in exploreation mode. More details ...
    ARGthe labels of the scalars on which the bias will act=z.node-0
    BARRIERthe free energy barrier to be overcome=250
    PACEthe frequency for kernel deposition=500
    TEMP temperature=350
...


The OPES_METAD_EXPLORE action with label opes calculates the following quantities: Quantity    Description  
opes.bias the instantaneous value of the bias potential
opes.rct estimate of c(t)
opes.zed estimate of Z_n
opes.neff effective sample size
opes.nker total number of compressed kernels used to represent the biasPRINTPrint quantities to a file. More details FILEthe name of the file on which to output these quantities=COLVAR ARGthe labels of the values that you would like to print to the file=z.node-0,z.bias-0,bias,opes.* STRIDE the frequency with which the quantities of interest should be output=500
Quantity	Description
p1.x	the x-component of the atom position
p1.y	the y-component of the atom position
p1.z	the z-component of the atom position
Quantity	Description
p2.x	the x-component of the atom position
p2.y	the y-component of the atom position
p2.z	the z-component of the atom position
Quantity	Description
p3.x	the x-component of the atom position
p3.y	the y-component of the atom position
p3.z	the z-component of the atom position
Quantity	Description
p4.x	the x-component of the atom position
p4.y	the y-component of the atom position
p4.z	the z-component of the atom position
Quantity	Description
p5.x	the x-component of the atom position
p5.y	the y-component of the atom position
p5.z	the z-component of the atom position
Quantity	Description
p6.x	the x-component of the atom position
p6.y	the y-component of the atom position
p6.z	the z-component of the atom position
Quantity	Description
p7.x	the x-component of the atom position
p7.y	the y-component of the atom position
p7.z	the z-component of the atom position
Quantity	Description
p8.x	the x-component of the atom position
p8.y	the y-component of the atom position
p8.z	the z-component of the atom position
Quantity	Description
p9.x	the x-component of the atom position
p9.y	the y-component of the atom position
p9.z	the z-component of the atom position
Quantity	Description
p10.x	the x-component of the atom position
p10.y	the y-component of the atom position
p10.z	the z-component of the atom position
Quantity	Description
p11.x	the x-component of the atom position
p11.y	the y-component of the atom position
p11.z	the z-component of the atom position
Quantity	Description
p12.x	the x-component of the atom position
p12.y	the y-component of the atom position
p12.z	the z-component of the atom position
Quantity	Description
p13.x	the x-component of the atom position
p13.y	the y-component of the atom position
p13.z	the z-component of the atom position
Quantity	Description
p14.x	the x-component of the atom position
p14.y	the y-component of the atom position
p14.z	the z-component of the atom position
Quantity	Description
p15.x	the x-component of the atom position
p15.y	the y-component of the atom position
p15.z	the z-component of the atom position
Quantity	Description
p16.x	the x-component of the atom position
p16.y	the y-component of the atom position
p16.z	the z-component of the atom position
Quantity	Description
p17.x	the x-component of the atom position
p17.y	the y-component of the atom position
p17.z	the z-component of the atom position
Quantity	Description
p18.x	the x-component of the atom position
p18.y	the y-component of the atom position
p18.z	the z-component of the atom position
Quantity	Description
p19.x	the x-component of the atom position
p19.y	the y-component of the atom position
p19.z	the z-component of the atom position
Quantity	Description
p20.x	the x-component of the atom position
p20.y	the y-component of the atom position
p20.z	the z-component of the atom position
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