# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.28431339
_cell_length_b   3.77736452
_cell_length_c   56.85746614
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.82447489
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H24
_cell_volume   490.554336412
_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  0.080167  0.742637  0.218861  1
  H  H2  1  0.580167  0.242637  0.200265  1
  H  H3  1  0.080167  0.742637  0.258011  1
  H  H4  1  0.580167  0.242637  0.239481  1
  H  H5  1  0.080167  0.742637  0.296811  1
  H  H6  1  0.580167  0.242637  0.278417  1
  H  H7  1  0.080167  0.742637  0.335284  1
  H  H8  1  0.580167  0.242637  0.318122  1
  H  H9  1  0.080167  0.242637  0.356381  1
  H  H10  1  0.580167  0.742637  0.371666  1
  H  H11  1  0.080167  0.742637  0.409243  1
  H  H12  1  0.580167  0.242637  0.393088  1
  H  H13  1  0.080167  0.742637  0.448343  1
  H  H14  1  0.580167  0.242637  0.432189  1
  H  H15  1  0.080167  0.242637  0.469765  1
  H  H16  1  0.580167  0.742637  0.485051  1
  H  H17  1  0.080167  0.742637  0.523310  1
  H  H18  1  0.580167  0.242637  0.506147  1
  H  H19  1  0.080167  0.742637  0.563014  1
  H  H20  1  0.580167  0.242637  0.544621  1
  H  H21  1  0.080167  0.742637  0.601951  1
  H  H22  1  0.580167  0.242637  0.583420  1
  H  H23  1  0.080167  0.742637  0.641166  1
  H  H24  1  0.580167  0.242637  0.622571  1
