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=-0.13988937527824816 stress="0.0741024811811819 -0.005451311029764008 0.07367208084020795 -0.005451311029764008 0.015584832245997361 -0.006721259175000375 0.07367208084020795 -0.006721259175000375 0.08391285743721598" free_energy=-0.13988937527824816 pbc="T F T"
H       2.77538150       0.22083292       2.78984966      -1.25213236       0.35153551      -1.44147705 
H       1.48735431       1.38731147       2.90698366      -0.38323198      -0.11061225      -0.66054748 
H       1.68107110       0.17498979       1.59995250       1.13483054      -0.01443095       1.31788627 
H       0.26120756       1.51193751       1.75226748       0.50053379      -0.22649230       0.78413826