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=-2.3837980912426153 stress="0.08240351660914103 0.062021177271876254 -0.029639392593777722 0.062021177271876254 0.17355846628166635 0.1086001598433288 -0.029639392593777722 0.1086001598433288 0.13520933773134397" free_energy=-2.3837980912426153 pbc="T F T"
H       2.67186163       0.22586561       0.29391194      -0.01024268       2.07029545       2.64746835 
H       1.40721639       1.34928466       2.74193353       0.24757516      -1.01996752      -0.95321883 
H       1.68220204       0.23573857       1.57120672       1.77911657       2.59914266       0.21286997 
H       2.77538150       1.20296332       1.34887301      -2.01644905      -3.64947058      -1.90711948