# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.27515807
_cell_length_b   5.79112492
_cell_length_c   43.09787767
_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   567.845767197
_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  0.638112  0.400106  0.340398  1
  H  H2  1  0.638112  0.796077  0.351879  1
  H  H3  1  0.138112  0.131387  0.372151  1
  H  H4  1  0.138112  0.528263  0.385545  1
  H  H5  1  0.638112  0.863855  0.404192  1
  H  H6  1  0.638112  0.259900  0.416928  1
  H  H7  1  0.138112  0.601224  0.437427  1
  H  H8  1  0.138112  0.988338  0.448565  1
  H  H9  1  0.638112  0.334597  0.468595  1
  H  H10  1  0.638112  0.719762  0.484335  1
  H  H11  1  0.138112  0.063354  0.498685  1
  H  H12  1  0.138112  0.433928  0.515015  1
  H  H13  1  0.138112  0.789057  0.534614  1
  H  H14  1  0.638112  0.142269  0.544427  1
  H  H15  1  0.638112  0.503584  0.562944  1
  H  H16  1  0.638112  0.866302  0.582079  1
  H  H17  1  0.138112  0.214855  0.591269  1
  H  H18  1  0.138112  0.577961  0.610156  1
  H  H19  1  0.138112  0.940867  0.629328  1
  H  H20  1  0.638112  0.288950  0.638267  1
  H  H21  1  0.638112  0.652182  0.657233  1
  H  H22  1  0.638112  1.015129  0.676417  1
  H  H23  1  0.138112  0.363781  0.685231  1
  H  H24  1  0.138112  0.725020  0.704060  1
  H  H25  1  0.138112  0.089652  0.723340  1
  H  H26  1  0.638112  0.435923  0.733220  1
  H  H27  1  0.638112  0.804135  0.751742  1
