# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.24602063
_cell_length_b   8.52887308
_cell_length_c   52.12497452
_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   H48
_cell_volume   998.507306649
_cell_formula_units_Z   24
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  0.243361  0.854112  0.234094  1
  H  H2  1  0.743361  0.104112  0.234094  1
  H  H3  1  0.243361  0.354112  0.234094  1
  H  H4  1  0.743361  0.604112  0.234094  1
  H  H5  1  0.243361  0.707654  0.270785  1
  H  H6  1  0.743361  0.957654  0.270785  1
  H  H7  1  0.243361  0.207654  0.270785  1
  H  H8  1  0.743361  0.457654  0.270785  1
  H  H9  1  0.243361  0.561035  0.307013  1
  H  H10  1  0.743361  0.811035  0.307013  1
  H  H11  1  0.243361  1.061035  0.307013  1
  H  H12  1  0.743361  0.311035  0.307013  1
  H  H13  1  0.243361  0.414290  0.343391  1
  H  H14  1  0.743361  0.664290  0.343391  1
  H  H15  1  0.243361  0.914290  0.343391  1
  H  H16  1  0.743361  0.164290  0.343391  1
  H  H17  1  0.243361  0.267714  0.379765  1
  H  H18  1  0.743361  0.517714  0.379765  1
  H  H19  1  0.243361  0.767714  0.379765  1
  H  H20  1  0.743361  1.017714  0.379765  1
  H  H21  1  0.243361  0.121115  0.416139  1
  H  H22  1  0.743361  0.371115  0.416139  1
  H  H23  1  0.243361  0.621115  0.416139  1
  H  H24  1  0.743361  0.871115  0.416139  1
  H  H25  1  0.243361  0.974518  0.452513  1
  H  H26  1  0.743361  0.224518  0.452513  1
  H  H27  1  0.243361  0.474518  0.452513  1
  H  H28  1  0.743361  0.724518  0.452513  1
  H  H29  1  0.243361  0.827919  0.488888  1
  H  H30  1  0.743361  1.077919  0.488888  1
  H  H31  1  0.243361  0.327919  0.488888  1
  H  H32  1  0.743361  0.577919  0.488888  1
  H  H33  1  0.243361  0.681343  0.525262  1
  H  H34  1  0.743361  0.931343  0.525262  1
  H  H35  1  0.243361  0.181343  0.525262  1
  H  H36  1  0.743361  0.431343  0.525262  1
  H  H37  1  0.243361  0.534598  0.561640  1
  H  H38  1  0.743361  0.784598  0.561640  1
  H  H39  1  0.243361  1.034598  0.561640  1
  H  H40  1  0.743361  0.284598  0.561640  1
  H  H41  1  0.243361  0.387979  0.597868  1
  H  H42  1  0.743361  0.637979  0.597868  1
  H  H43  1  0.243361  0.887979  0.597868  1
  H  H44  1  0.743361  0.137979  0.597868  1
  H  H45  1  0.243361  0.241521  0.634559  1
  H  H46  1  0.743361  0.491521  0.634559  1
  H  H47  1  0.243361  0.741521  0.634559  1
  H  H48  1  0.743361  0.991521  0.634559  1
