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=0.05654687565173522 stress="-0.004279255686188192 0.0022443092001409896 0.0020441610131018283 0.0022443092001409896 -0.01548320210880682 -0.0009465580382070735 0.0020441610131018283 -0.0009465580382070735 -0.002708462081325469" free_energy=0.05654687565173522 pbc="T F T"
H       -0.19401975       0.01361598      -0.14801295       0.12864495      -0.11608962       0.05779745
H        1.47567541       1.56329927      -0.06254558      -0.14840452       0.14015083      -0.01439309
H        1.27846858       0.09073906       1.77219963      -0.08919851      -0.15564246      -0.07664440
H        0.11747042       1.63132919       1.75978669       0.10895807       0.13158125       0.03324004