# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   1.06615731
_cell_length_b   4.97130871
_cell_length_c   48.50948206
_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   H16
_cell_volume   257.109816865
_cell_formula_units_Z   8
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  0.000000  0.542323  0.308824  1
  H  H2  1  0.000000  0.038292  0.279412  1
  H  H3  1  0.000000  0.550385  0.367647  1
  H  H4  1  0.000000  0.046354  0.338235  1
  H  H5  1  0.000000  0.558446  0.426471  1
  H  H6  1  0.000000  0.054415  0.397059  1
  H  H7  1  0.000000  0.566508  0.485294  1
  H  H8  1  0.000000  0.062477  0.455882  1
  H  H9  1  0.000000  0.574569  0.544118  1
  H  H10  1  0.000000  0.070539  0.514706  1
  H  H11  1  0.000000  0.582631  0.602941  1
  H  H12  1  0.000000  0.078600  0.573529  1
  H  H13  1  0.000000  0.590692  0.661765  1
  H  H14  1  0.000000  0.086662  0.632353  1
  H  H15  1  0.000000  0.598754  0.720588  1
  H  H16  1  0.000000  0.094723  0.691176  1
