# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.64829196
_cell_length_b   4.40685167
_cell_length_c   58.01643365
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   75.20842278
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H56
_cell_volume   1149.04456154
_cell_formula_units_Z   28
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  0.073233  0.194188  0.198870  1
  H  H2  1  0.573233  0.194188  0.198870  1
  H  H3  1  0.437987  0.721774  0.204058  1
  H  H4  1  0.937987  0.721774  0.204058  1
  H  H5  1  0.135536  0.933708  0.235262  1
  H  H6  1  0.635536  0.933708  0.235262  1
  H  H7  1  0.770709  0.399549  0.230582  1
  H  H8  1  0.270709  0.399549  0.230582  1
  H  H9  1  0.468469  0.608948  0.261105  1
  H  H10  1  0.968469  0.608948  0.261105  1
  H  H11  1  0.833795  0.143158  0.266132  1
  H  H12  1  0.333795  0.143158  0.266132  1
  H  H13  1  0.532061  0.352639  0.296920  1
  H  H14  1  0.032061  0.352639  0.296920  1
  H  H15  1  0.166793  0.817456  0.291731  1
  H  H16  1  0.666793  0.817456  0.291731  1
  H  H17  1  0.865144  1.026222  0.322421  1
  H  H18  1  0.365144  1.026222  0.322421  1
  H  H19  1  0.230326  0.561816  0.327676  1
  H  H20  1  0.730326  0.561816  0.327676  1
  H  H21  1  0.928580  0.770910  0.358412  1
  H  H22  1  0.428580  0.770910  0.358412  1
  H  H23  1  0.563456  0.235151  0.353132  1
  H  H24  1  0.063456  0.235151  0.353132  1
  H  H25  1  0.261731  0.444160  0.383851  1
  H  H26  1  0.761731  0.444160  0.383851  1
  H  H27  1  0.626828  0.979973  0.389139  1
  H  H28  1  0.126828  0.979973  0.389139  1
  H  H29  1  0.325083  0.189014  0.419862  1
  H  H30  1  0.825083  0.189014  0.419862  1
  H  H31  1  0.959985  0.653201  0.414574  1
  H  H32  1  0.459985  0.653201  0.414574  1
  H  H33  1  0.658234  0.862264  0.445301  1
  H  H34  1  0.158234  0.862264  0.445301  1
  H  H35  1  0.023358  0.398022  0.450580  1
  H  H36  1  0.523358  0.398022  0.450580  1
  H  H37  1  0.721670  0.606951  0.481291  1
  H  H38  1  0.221670  0.606951  0.481291  1
  H  H39  1  0.356488  0.071358  0.476037  1
  H  H40  1  0.856488  0.071358  0.476037  1
  H  H41  1  0.054753  0.280535  0.506792  1
  H  H42  1  0.554753  0.280535  0.506792  1
  H  H43  1  0.420021  0.815718  0.511981  1
  H  H44  1  0.920021  0.815718  0.511981  1
  H  H45  1  0.118345  1.024226  0.542607  1
  H  H46  1  0.618345  1.024226  0.542607  1
  H  H47  1  0.753019  0.490016  0.537580  1
  H  H48  1  0.253019  0.490016  0.537580  1
  H  H49  1  0.451278  0.699466  0.568450  1
  H  H50  1  0.951278  0.699466  0.568450  1
  H  H51  1  0.816105  0.233624  0.573131  1
  H  H52  1  0.316105  0.233624  0.573131  1
  H  H53  1  0.513581  0.438986  0.604842  1
  H  H54  1  1.013581  0.438986  0.604842  1
  H  H55  1  0.148827  0.911400  0.599655  1
  H  H56  1  0.648827  0.911400  0.599655  1
