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=-2.218178558014697 stress="5.325216986651853 0.18686246632813946 0.053244799333041826 0.18686246632813946 5.352743343513853 0.20503908587526887 0.053244799333041826 0.20503908587526887 5.411989552218041" pbc="F F F"
H       0.26959405       0.17626233      -0.14597521       1.55831969       2.03449859       2.60305588 
H       1.70996341       1.49207130       0.15300231      -2.10555044      -2.14853733       1.28280506 
H       1.53848316      -0.04225341       1.41852158      -1.34245739       1.86219779      -1.96900134 
H      -0.04210664       1.38825682       1.27041603       1.88968814      -1.74815905      -1.91685960