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=-3.2314373332249477 stress="5.924333331227386 -0.41683432604668375 -0.08472086460130779 -0.41683432604668375 5.051460617215108 -0.14340722678260676 -0.08472086460130779 -0.14340722678260676 5.370810983009352" pbc="F F F"
H       0.23171545       0.18190327      -0.17816502       1.68011391       1.54067718       1.89031892 
H       1.71219253       1.42485375       0.12990665      -2.08431487      -1.98669726       1.44586344 
H       1.28220450       0.28278197       1.56210000      -2.43684907       2.96179186      -2.07481496 
H       0.13362859       1.32702941       1.57034430       2.84105002      -2.51577178      -1.26136740