# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.69134886
_cell_length_b   4.54275692
_cell_length_c   54.48131598
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   62.56748613
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H48
_cell_volume   1030.52764601
_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  0.178645  0.182212  0.245963  1
  H  H2  1  0.678645  0.182212  0.245963  1
  H  H3  1  0.178645  0.682212  0.245963  1
  H  H4  1  0.678645  0.682212  0.245963  1
  H  H5  1  0.880347  0.329266  0.281164  1
  H  H6  1  0.380347  0.329266  0.281164  1
  H  H7  1  0.880347  0.829266  0.281164  1
  H  H8  1  0.380347  0.829266  0.281164  1
  H  H9  1  0.582212  0.475946  0.315898  1
  H  H10  1  0.082212  0.475946  0.315898  1
  H  H11  1  0.582212  0.975946  0.315898  1
  H  H12  1  0.082212  0.975946  0.315898  1
  H  H13  1  0.283650  0.623048  0.350775  1
  H  H14  1  0.783650  0.623048  0.350775  1
  H  H15  1  0.283650  0.123048  0.350775  1
  H  H16  1  0.783650  0.123048  0.350775  1
  H  H17  1  0.985963  0.769381  0.385630  1
  H  H18  1  0.485963  0.769381  0.385630  1
  H  H19  1  0.985963  0.269381  0.385630  1
  H  H20  1  0.485963  0.269381  0.385630  1
  H  H21  1  0.685440  0.918387  0.420678  1
  H  H22  1  0.185440  0.918387  0.420678  1
  H  H23  1  0.685440  0.418387  0.420678  1
  H  H24  1  0.185440  0.418387  0.420678  1
  H  H25  1  0.989895  0.765622  0.455959  1
  H  H26  1  0.489895  0.765622  0.455959  1
  H  H27  1  0.989895  0.265622  0.455959  1
  H  H28  1  0.489895  0.265622  0.455959  1
  H  H29  1  0.689373  0.914628  0.491007  1
  H  H30  1  0.189373  0.914628  0.491007  1
  H  H31  1  0.689373  0.414628  0.491007  1
  H  H32  1  0.189373  0.414628  0.491007  1
  H  H33  1  0.391686  0.060961  0.525863  1
  H  H34  1  0.891686  0.060961  0.525863  1
  H  H35  1  0.391686  0.560961  0.525863  1
  H  H36  1  0.891686  0.560961  0.525863  1
  H  H37  1  0.093123  0.208063  0.560740  1
  H  H38  1  0.593123  0.208063  0.560740  1
  H  H39  1  0.093123  0.708063  0.560740  1
  H  H40  1  0.593123  0.708063  0.560740  1
  H  H41  1  0.794989  0.354743  0.595474  1
  H  H42  1  0.294989  0.354743  0.595474  1
  H  H43  1  0.794989  0.854743  0.595474  1
  H  H44  1  0.294989  0.854743  0.595474  1
  H  H45  1  0.496690  0.501797  0.630675  1
  H  H46  1  0.996690  0.501797  0.630675  1
  H  H47  1  0.496690  1.001797  0.630675  1
  H  H48  1  0.996690  1.001797  0.630675  1
