# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.27060677
_cell_length_b   9.70642656
_cell_length_c   48.74741435
_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   H52
_cell_volume   1074.36756056
_cell_formula_units_Z   26
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  0.611308  0.322793  0.265634  1
  H  H2  1  0.611308  0.746301  0.281969  1
  H  H3  1  1.111308  0.957410  0.289998  1
  H  H4  1  1.111308  0.535628  0.273764  1
  H  H5  1  0.611308  0.164616  0.299224  1
  H  H6  1  0.611308  0.583456  0.315737  1
  H  H7  1  1.111308  0.792671  0.323912  1
  H  H8  1  1.111308  0.374744  0.307763  1
  H  H9  1  0.611308  0.000981  0.332388  1
  H  H10  1  0.611308  0.420363  0.349028  1
  H  H11  1  1.111308  0.629624  0.357193  1
  H  H12  1  1.111308  0.210748  0.340734  1
  H  H13  1  0.611308  0.838384  0.365573  1
  H  H14  1  0.611308  0.257068  0.382306  1
  H  H15  1  1.111308  0.466450  0.390604  1
  H  H16  1  1.111308  0.047651  0.373958  1
  H  H17  1  0.611308  0.675481  0.398913  1
  H  H18  1  0.611308  0.094004  0.415613  1
  H  H19  1  1.111308  0.303346  0.423942  1
  H  H20  1  1.111308  0.884682  0.407263  1
  H  H21  1  0.611308  0.512557  0.432272  1
  H  H22  1  0.611308  0.931008  0.448935  1
  H  H23  1  1.111308  0.140296  0.457271  1
  H  H24  1  1.111308  0.721754  0.440598  1
  H  H25  1  0.611308  0.349551  0.465607  1
  H  H26  1  0.611308  0.768030  0.482268  1
  H  H27  1  1.111308  0.977276  0.490600  1
  H  H28  1  1.111308  0.558797  0.473940  1
  H  H29  1  0.611308  0.186531  0.498936  1
  H  H30  1  0.611308  0.605073  0.515610  1
  H  H31  1  1.111308  0.814270  0.523936  1
  H  H32  1  1.111308  0.395819  0.507272  1
  H  H33  1  0.611308  0.023481  0.532265  1
  H  H34  1  0.611308  0.442146  0.548945  1
  H  H35  1  1.111308  0.651346  0.557294  1
  H  H36  1  1.111308  0.232823  0.540594  1
  H  H37  1  0.611308  0.860377  0.565603  1
  H  H38  1  0.611308  0.279176  0.582250  1
  H  H39  1  1.111308  0.488444  0.590634  1
  H  H40  1  1.111308  0.069760  0.573901  1
  H  H41  1  0.611308  0.697203  0.599014  1
  H  H42  1  0.611308  0.116079  0.615474  1
  H  H43  1  1.111308  0.325846  0.623819  1
  H  H44  1  1.111308  0.906464  0.607179  1
  H  H45  1  0.611308  0.534156  0.632296  1
  H  H46  1  0.611308  0.952083  0.648445  1
  H  H47  1  1.111308  0.162212  0.656983  1
  H  H48  1  1.111308  0.743371  0.640471  1
  H  H49  1  0.611308  0.369417  0.666210  1
  H  H50  1  0.611308  0.791199  0.682443  1
  H  H51  1  1.111308  0.004034  0.690574  1
  H  H52  1  1.111308  0.580526  0.674239  1
