# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.89826923
_cell_length_b   8.20865095
_cell_length_c   49.91710948
_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   1597.3241151
_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  -0.000125  0.626115  0.307360  1
  H  H2  1  0.499875  0.287889  0.345822  1
  H  H3  1  0.499875  0.351599  0.281719  1
  H  H4  1  -0.000125  0.013373  0.320181  1
  H  H5  1  0.499875  0.300345  0.269534  1
  H  H6  1  -0.000125  0.962119  0.307995  1
  H  H7  1  -0.000125  0.574861  0.295175  1
  H  H8  1  0.499875  0.236635  0.333636  1
  H  H9  1  -0.000125  0.949664  0.384283  1
  H  H10  1  0.499875  0.611438  0.422745  1
  H  H11  1  0.499875  0.675148  0.358642  1
  H  H12  1  -0.000125  0.336922  0.397104  1
  H  H13  1  0.499875  0.623894  0.346457  1
  H  H14  1  -0.000125  0.285668  0.384918  1
  H  H15  1  -0.000125  0.898410  0.372098  1
  H  H16  1  0.499875  0.560184  0.410559  1
  H  H17  1  -0.000125  0.273212  0.461206  1
  H  H18  1  0.499875  0.934986  0.499668  1
  H  H19  1  0.499875  0.998696  0.435565  1
  H  H20  1  -0.000125  0.660470  0.474027  1
  H  H21  1  0.499875  0.947442  0.423380  1
  H  H22  1  -0.000125  0.609216  0.461841  1
  H  H23  1  -0.000125  0.221958  0.449021  1
  H  H24  1  0.499875  0.883732  0.487482  1
  H  H25  1  -0.000125  0.596760  0.538129  1
  H  H26  1  0.499875  0.258535  0.576591  1
  H  H27  1  0.499875  0.322244  0.512488  1
  H  H28  1  -0.000125  0.984019  0.550950  1
  H  H29  1  0.499875  0.270990  0.500303  1
  H  H30  1  -0.000125  0.932765  0.538764  1
  H  H31  1  -0.000125  0.545506  0.525944  1
  H  H32  1  0.499875  0.207281  0.564405  1
  H  H33  1  -0.000125  0.920309  0.615053  1
  H  H34  1  0.499875  0.582083  0.653514  1
  H  H35  1  0.499875  0.645793  0.589412  1
  H  H36  1  -0.000125  0.307567  0.627873  1
  H  H37  1  0.499875  0.594539  0.577226  1
  H  H38  1  -0.000125  0.256313  0.615688  1
  H  H39  1  -0.000125  0.869055  0.602867  1
  H  H40  1  0.499875  0.530829  0.641329  1
  H  H41  1  -0.000125  0.243857  0.691976  1
  H  H42  1  0.499875  0.905632  0.730437  1
  H  H43  1  0.499875  0.969341  0.666335  1
  H  H44  1  -0.000125  0.631115  0.704796  1
  H  H45  1  0.499875  0.918087  0.654149  1
  H  H46  1  -0.000125  0.579861  0.692611  1
  H  H47  1  -0.000125  0.192603  0.679790  1
  H  H48  1  0.499875  0.854378  0.718252  1
