# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.43139450
_cell_length_b   7.69245410
_cell_length_c   35.17302774
_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   H32
_cell_volume   657.85487592
_cell_formula_units_Z   16
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  0.984878  0.823540  0.485923  1
  H  H2  1  0.484878  0.567865  0.485923  1
  H  H3  1  0.984878  0.321802  0.502648  1
  H  H4  1  0.484878  0.069602  0.502648  1
  H  H5  1  0.484878  0.820979  0.542318  1
  H  H6  1  0.984878  0.570425  0.542318  1
  H  H7  1  0.484878  0.321377  0.558493  1
  H  H8  1  0.984878  0.070027  0.558493  1
  H  H9  1  0.984878  0.821326  0.597755  1
  H  H10  1  0.484878  0.570078  0.597755  1
  H  H11  1  0.984878  0.321314  0.613996  1
  H  H12  1  0.484878  0.070090  0.613996  1
  H  H13  1  0.484878  0.821332  0.653384  1
  H  H14  1  0.984878  0.570073  0.653384  1
  H  H15  1  0.484878  0.321322  0.669637  1
  H  H16  1  0.984878  0.070082  0.669637  1
  H  H17  1  0.984878  0.821322  0.709038  1
  H  H18  1  0.484878  0.570082  0.709038  1
  H  H19  1  0.984878  0.321332  0.725291  1
  H  H20  1  0.484878  0.070073  0.725291  1
  H  H21  1  0.484878  0.821314  0.764680  1
  H  H22  1  0.984878  0.570090  0.764680  1
  H  H23  1  0.484878  0.321326  0.780920  1
  H  H24  1  -0.015122  0.070078  0.780920  1
  H  H25  1  0.984878  0.821377  0.820182  1
  H  H26  1  0.484878  0.570027  0.820182  1
  H  H27  1  -0.015122  0.320979  0.836357  1
  H  H28  1  0.484878  0.070425  0.836357  1
  H  H29  1  0.484878  0.821802  0.876028  1
  H  H30  1  0.984878  0.569602  0.876028  1
  H  H31  1  0.484878  0.323540  0.892753  1
  H  H32  1  0.984878  0.067865  0.892753  1
