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=0.5517972142112179 stress="-0.04343597963860247 0.0038328160064073137 -0.0010386171049769869 0.0038328160064073137 -0.03196002412900284 0.004007628350049625 -0.0010386171049769869 0.004007628350049625 -0.027230235723516464" pbc="T F F"
H      -0.15943142       0.09073906       0.27219963      -0.05348624      -0.28913018      -0.28387203 
H       1.26084267       1.63132919       0.25978669       0.06597263       0.29720475      -0.26834458 
H       1.22592512       0.18365717       1.70288723       0.17090075      -0.37293823       0.32393677 
H       0.15377761       1.29585403       1.44809454      -0.18338714       0.36486366       0.22827984