# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.75568769
_cell_length_b   7.45707137
_cell_length_c   46.61009638
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   116.93451893
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H22
_cell_volume   2093.39551249
_cell_formula_units_Z   11
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  0.208220  0.083107  0.310000  1
  H  H2  1  0.646400  0.626132  0.290000  1
  H  H3  1  0.665195  0.997056  0.350000  1
  H  H4  1  0.103374  0.540082  0.330000  1
  H  H5  1  0.122169  0.911006  0.390000  1
  H  H6  1  0.560349  0.454031  0.370000  1
  H  H7  1  0.579144  0.824955  0.430000  1
  H  H8  1  0.017323  0.367980  0.410000  1
  H  H9  1  0.036119  0.738904  0.470000  1
  H  H10  1  0.474298  0.281930  0.450000  1
  H  H11  1  0.493093  0.652854  0.510000  1
  H  H12  1  0.931273  0.195879  0.490000  1
  H  H13  1  0.950068  0.566803  0.550000  1
  H  H14  1  0.388247  0.109828  0.530000  1
  H  H15  1  0.407043  0.480752  0.590000  1
  H  H16  1  0.845222  0.023777  0.570000  1
  H  H17  1  0.864017  0.394701  0.630000  1
  H  H18  1  0.302197  0.937727  0.610000  1
  H  H19  1  0.320992  0.308651  0.670000  1
  H  H20  1  0.759171  0.851676  0.650000  1
  H  H21  1  0.777967  0.222600  0.710000  1
  H  H22  1  0.216146  0.765625  0.690000  1
