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=-4.288402590932693 pbc="T F T"
H       0.20947124      -0.14487149       0.05280714        1       1.97028810       2.21316037       1.09391648 
H       1.41333883       1.34655491      -0.12758765        1      -0.77435089      -2.26627156      -0.71466996 
H       1.32230844      -0.08950840       1.22286420        1      -1.81152916       2.00096140      -1.48156811 
H      -0.06141927       1.25205420       1.65488783        1       0.61559195      -1.94785021       1.10232159