# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.26670343
_cell_length_b   5.72038469
_cell_length_c   43.18823325
_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   H28
_cell_volume   559.99658115
_cell_formula_units_Z   14
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  0.686029  0.989142  0.345423  1
  H  H2  1  0.186029  0.340113  0.329884  1
  H  H3  1  0.686029  0.304635  0.378401  1
  H  H4  1  0.186029  0.649378  0.362095  1
  H  H5  1  0.686029  0.620631  0.410011  1
  H  H6  1  0.186029  0.963976  0.394126  1
  H  H7  1  0.686029  0.935361  0.442015  1
  H  H8  1  0.186029  0.278158  0.426096  1
  H  H9  1  0.686029  0.249945  0.474065  1
  H  H10  1  0.186029  0.592823  0.458034  1
  H  H11  1  0.686029  0.564502  0.506072  1
  H  H12  1  0.186029  0.907260  0.490059  1
  H  H13  1  0.686029  0.878995  0.538095  1
  H  H14  1  0.186029  0.221746  0.522089  1
  H  H15  1  0.686029  0.193506  0.570115  1
  H  H16  1  0.186029  0.536257  0.554109  1
  H  H17  1  0.686029  0.507993  0.602146  1
  H  H18  1  0.186029  0.850750  0.586132  1
  H  H19  1  0.686029  0.822430  0.634170  1
  H  H20  1  0.186029  0.165308  0.618139  1
  H  H21  1  0.686029  0.137095  0.666108  1
  H  H22  1  0.186029  0.479892  0.650189  1
  H  H23  1  0.686029  0.451277  0.698078  1
  H  H24  1  0.186029  0.794621  0.682193  1
  H  H25  1  0.686029  0.765874  0.730110  1
  H  H26  1  0.186029  0.110617  0.713803  1
  H  H27  1  0.686029  0.075139  0.762320  1
  H  H28  1  0.186029  0.426111  0.746782  1
