16
Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-4.864774835216806 stress="0.00013030086207997202 7.33820293690992e-05 -1.0643652558699144e-05 7.33820293690992e-05 0.00015260538405621502 3.567806543768114e-05 -1.0643652558699144e-05 3.567806543768114e-05 0.00021317597612406877" free_energy=-4.864774835216806 pbc="F F F"
F      21.05503361      21.16630885      20.96874127       0.38803070       0.37786697       0.28302696 
C      22.71005355      22.71211731      22.44968690       1.32805264       1.05963191      -2.47690375 
C      24.29594673      21.15710459      20.99042854       0.96429285       1.20226361       1.41394329 
F      25.35687199      22.47664413      22.74122900      -1.93261961      -1.74585662       0.24598635 
H      20.97832541      24.06478267      21.06966902      -0.02362226      -0.01359998      -0.03697622 
C      22.48566276      25.31443107      22.54376171       0.63045448      -0.48233225      -0.72258673 
F      23.72051529      23.95297482      20.80722932      -2.06612045      -1.21902377       3.15528555 
H      25.51022410      25.74351529      22.58314188      -0.00567233      -0.00093222      -0.03303590 
F      21.23110688      20.99816022      24.01283276       1.17576688       0.99483389       0.71725962 
C      22.70071341      22.32858036      25.64720807      -0.10298884      -1.52334085      -1.57079483 
C      24.08942344      20.95706424      24.38441294       0.59940491       2.92488801       0.88093291 
C      25.21321713      22.71736445      25.28604778      -1.09555830      -1.35707996      -2.29388881 
H      21.33634388      23.89255775      23.78657544      -0.11025950      -0.05136620       0.06876728 
F      22.35472895      25.53562958      25.49016751       0.03649370       0.01469953      -0.10241347 
H      24.04980412      23.79870192      23.93121987       0.20968981      -0.18195196       0.44200844 
H      25.44687702      25.39458582      25.46919098       0.00465531       0.00129989       0.02938930