# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.22136314
_cell_length_b   7.77111006
_cell_length_c   54.34132042
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H44
_cell_volume   938.064730011
_cell_formula_units_Z   22
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  H  H1  1  0.747916  0.564170  0.258935  1
  H  H2  1  0.247916  0.381420  0.230115  1
  H  H3  1  0.747916  0.109771  0.239527  1
  H  H4  1  0.247916  0.834924  0.248723  1
  H  H5  1  0.747916  0.471883  0.298342  1
  H  H6  1  0.247916  0.289195  0.269510  1
  H  H7  1  0.747916  1.016633  0.278859  1
  H  H8  1  0.247916  0.744798  0.288523  1
  H  H9  1  0.747916  0.378992  0.337665  1
  H  H10  1  0.247916  0.197526  0.308381  1
  H  H11  1  0.747916  0.924516  0.318043  1
  H  H12  1  0.247916  0.651903  0.327816  1
  H  H13  1  0.747916  0.286631  0.376992  1
  H  H14  1  0.247916  0.105514  0.347573  1
  H  H15  1  0.747916  0.832504  0.357347  1
  H  H16  1  0.247916  0.559627  0.367151  1
  H  H17  1  0.747916  0.194378  0.416301  1
  H  H18  1  0.247916  1.013426  0.386842  1
  H  H19  1  0.747916  0.740383  0.396651  1
  H  H20  1  0.247916  0.467414  0.406470  1
  H  H21  1  0.747916  0.102179  0.455602  1
  H  H22  1  0.247916  0.921262  0.426134  1
  H  H23  1  0.747916  0.648219  0.435957  1
  H  H24  1  0.247916  0.375222  0.445779  1
  H  H25  1  0.747916  1.010014  0.494894  1
  H  H26  1  0.247916  0.829063  0.465435  1
  H  H27  1  0.747916  0.556027  0.475266  1
  H  H28  1  0.247916  0.283057  0.485085  1
  H  H29  1  0.747916  0.917927  0.534163  1
  H  H30  1  0.247916  0.736810  0.504744  1
  H  H31  1  0.747916  0.463814  0.514584  1
  H  H32  1  0.247916  0.190937  0.524389  1
  H  H33  1  0.747916  0.825915  0.573355  1
  H  H34  1  0.247916  0.644449  0.544070  1
  H  H35  1  0.747916  0.371538  0.553919  1
  H  H36  1  0.247916  0.098925  0.563693  1
  H  H37  1  0.747916  0.734246  0.612225  1
  H  H38  1  0.247916  0.551558  0.583394  1
  H  H39  1  0.747916  0.278643  0.593213  1
  H  H40  1  0.247916  1.006808  0.602876  1
  H  H41  1  0.747916  0.642021  0.651621  1
  H  H42  1  0.247916  0.459271  0.622801  1
  H  H43  1  0.747916  0.188517  0.633013  1
  H  H44  1  0.247916  0.913670  0.642209  1
