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=-4.9163162801088545 stress="0.2194526714105084 0.006711936475285324 0.0057528789721830505 0.006711936475285324 0.20700262476695167 -0.018082095871073095 0.0057528789721830505 -0.018082095871073095 0.31425430287140943" pbc="F F T"
H       0.03369179       0.02598936      -0.27670350       1.91053651       2.35192524      -0.88514539 
H       1.46375436       1.40583543      -0.24440284      -2.05511888      -2.13012808      -0.55799717 
H       1.20178472       0.29874826       1.27290972      -2.61480028       2.51039942       0.53090302 
H       0.05835534       1.24645637       1.48193431       2.75938265      -2.73219658       0.91223954