4
Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=6455.07013459572 stress="-810.6972572930837 234.74677234335013 -189.6436251712654 234.74677234335013 -1077.0216604864297 -342.9622124405153 -189.6436251712654 -342.9622124405153 -996.3889544316406" free_energy=6455.07013459572 pbc="F T F"
Xe       0.11041876      -0.03194186       0.08611608   -9783.98518486   -1142.45956650  -12424.87859604
Xe       1.53369179       1.52598936       0.29874826    6089.17660837   -6792.53977525   -9773.16496486
Xe       1.27290972      -0.11909813       1.36136659   11044.89827444    3081.45860049   16620.05960985
Xe       0.05835534       1.24645637       1.48193431   -7350.08969795    4853.54074126    5577.98395105