# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.27485957
_cell_length_b   5.84953208
_cell_length_c   42.53738454
_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   H27
_cell_volume   566.039193756
_cell_formula_units_Z   13
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  0.193725  0.223972  0.381959  1
  H  H2  1  0.193725  0.866189  0.362156  1
  H  H3  1  0.693725  0.508862  0.353343  1
  H  H4  1  0.693725  0.298533  0.429479  1
  H  H5  1  0.693725  0.935225  0.410493  1
  H  H6  1  0.193725  0.588470  0.401398  1
  H  H7  1  0.193725  0.371855  0.477130  1
  H  H8  1  0.193725  1.009661  0.457897  1
  H  H9  1  0.693725  0.660576  0.448829  1
  H  H10  1  0.693725  0.445480  0.524789  1
  H  H11  1  0.693725  0.083098  0.505546  1
  H  H12  1  0.193725  0.734362  0.496416  1
  H  H13  1  0.193725  0.519038  0.572441  1
  H  H14  1  0.193725  0.156652  0.553200  1
  H  H15  1  0.693725  0.807892  0.544060  1
  H  H16  1  0.693725  0.592565  0.620081  1
  H  H17  1  0.693725  0.230214  0.600856  1
  H  H18  1  0.193725  0.881455  0.591713  1
  H  H19  1  0.193725  0.666359  0.667645  1
  H  H20  1  0.193725  0.303737  0.648522  1
  H  H21  1  0.693725  0.955120  0.639369  1
  H  H22  1  0.693725  0.738739  0.714968  1
  H  H23  1  0.693725  0.378091  0.696058  1
  H  H24  1  0.193725  0.028727  0.686990  1
  H  H25  1  0.193725  0.816448  0.763147  1
  H  H26  1  0.193725  0.449497  0.744532  1
  H  H27  1  0.693725  0.102559  0.734525  1
