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=-2.0194284390590296 stress="-0.6555999804496594 0.11648114590253517 -0.15196556464766442 0.11648114590253517 -0.6627759664629939 -0.10936530140839541 -0.15196556464766442 -0.10936530140839541 -0.7470100433931954" pbc="T T T"
H      -0.14459490       0.11115480       0.11044915       5.31357171      -7.88036295      -2.73340230 
H       1.70960170       1.31143450       0.04092907      -9.07375564       6.47129643      -3.52940504 
H       1.35333724       0.05786860       1.64041416      -1.62405971      -3.57707766      -0.53503030 
H      -0.22187219       1.37281364       1.32834452       5.38424364       4.98614418       6.79783765