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=10752.956797984818 pbc="T T F"
Bk       0.22577782       0.19035129       0.28249606       97  -23344.77162557  -27859.50132751   -7205.96237977 
Bk       1.49301446       1.28648422       0.09275243       97   23803.08574367   24589.04467220   -7593.89993713 
Bk       1.70272927      -0.01822871       1.65558808       97   -7831.32606529  -10558.08341598    4944.18679670 
Bk      -0.01068233       1.25924794       1.78981404       97    7373.01194720   13828.54007129    9855.67552020