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=-0.5951267696945524 stress="-0.2780283972274062 -0.003443309281949338 0.03293744556144017 -0.003443309281949338 -0.3499132454748481 -0.030987216223893586 0.03293744556144017 -0.030987216223893586 -0.19691417372328623" pbc="F F T"
H       0.10170120       0.00082602       0.24624097      -2.21428700      -3.56375933      -2.68723799 
H       1.64302402       1.35498893       0.11042859       3.07325431       3.06837011      -3.51730858 
H       1.70947124       0.05280714       1.41333883       1.81114458      -2.99934216       2.70297368 
H       0.15488783       1.55988540       1.20245745      -2.67011188       3.49473139       3.50157289