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:Z:I:1:forces:R:3 energy=-6.737341065847415 pbc="T T T" H 0.08611608 0.03369179 0.02598936 1 -4.48838533 -7.73603748 -0.29966417 H 0.47329650 0.46021073 -0.09416457 1 6.52053229 6.51089106 -4.15529900 H 0.48753147 -0.09751325 0.75217785 1 1.17214462 -1.98892914 1.65460269 H -0.22709028 0.63090187 0.61136659 1 -3.20429159 3.21407556 2.80036048