# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.30031261
_cell_length_b   4.02712174
_cell_length_c   53.52828304
_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   H24
_cell_volume   495.866685832
_cell_formula_units_Z   12
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  0.012509  0.174204  0.253483  1
  H  H2  1  0.512509  1.001043  0.289042  1
  H  H3  1  1.012509  0.828807  0.324366  1
  H  H4  1  0.512509  1.001952  0.359859  1
  H  H5  1  0.512509  0.674204  0.253483  1
  H  H6  1  0.012509  0.501043  0.289042  1
  H  H7  1  0.512509  0.328807  0.324366  1
  H  H8  1  1.012509  0.501952  0.359859  1
  H  H9  1  0.012509  0.175122  0.395367  1
  H  H10  1  0.512509  1.003972  0.430849  1
  H  H11  1  1.012509  0.833961  0.465866  1
  H  H12  1  0.512509  0.662811  0.501348  1
  H  H13  1  0.512509  0.675122  0.395367  1
  H  H14  1  0.012509  0.503972  0.430849  1
  H  H15  1  0.512509  0.333961  0.465866  1
  H  H16  1  1.012509  1.162811  0.501348  1
  H  H17  1  0.012509  0.835981  0.536856  1
  H  H18  1  0.512509  1.009126  0.572349  1
  H  H19  1  1.012509  0.836891  0.607672  1
  H  H20  1  0.512509  0.663730  0.643232  1
  H  H21  1  0.512509  0.335981  0.536856  1
  H  H22  1  0.012509  0.509126  0.572349  1
  H  H23  1  0.512509  0.336891  0.607672  1
  H  H24  1  1.012509  1.163730  0.643232  1
