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=2.701049210136977 stress="-0.6730626960695206 -0.053576792412869154 -0.03339078214052028 -0.053576792412869154 -0.7534403896187745 0.2514280027736132 -0.03339078214052028 0.2514280027736132 -0.8651859468984989" pbc="T T F"
H       0.05988540      -0.29754255       0.16431082      -5.49337735      12.34503791     -14.33324209 
H       1.31425730       1.48844065       0.03277713       5.25024599      -4.66209508      -5.14878590 
H       1.23068471      -0.12633864       1.46097674       6.83120925       5.52768384       6.17611284 
H       0.00805869       1.71813893       1.26716069      -6.58807789     -13.21062667      13.30591515