# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.26548943
_cell_length_b   2.26548943
_cell_length_c   41.92531359
_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   H11
_cell_volume   215.179255985
_cell_formula_units_Z   5
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  0.208990  0.450633  0.358680  1
  H  H2  1  0.708990  0.950633  0.400870  1
  H  H3  1  0.208990  0.450633  0.442285  1
  H  H4  1  0.708990  0.950633  0.483905  1
  H  H5  1  0.208990  0.450633  0.525557  1
  H  H6  1  0.708990  0.950633  0.567207  1
  H  H7  1  0.208990  0.450633  0.608858  1
  H  H8  1  0.708990  0.950633  0.650510  1
  H  H9  1  0.208990  0.450633  0.692130  1
  H  H10  1  0.708990  0.950633  0.733544  1
  H  H11  1  0.208990  0.450633  0.775735  1
