# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   1.06615731
_cell_length_b   7.52202007
_cell_length_c   47.14698986
_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   H22
_cell_volume   378.10267189
_cell_formula_units_Z   11
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  0.942184  0.290000  1
  H  H2  1  0.000000  0.300265  0.310000  1
  H  H3  1  0.000000  0.658347  0.330000  1
  H  H4  1  0.000000  0.016428  0.350000  1
  H  H5  1  0.000000  0.374510  0.370000  1
  H  H6  1  0.000000  0.732592  0.390000  1
  H  H7  1  0.000000  0.090673  0.410000  1
  H  H8  1  0.000000  0.448755  0.430000  1
  H  H9  1  0.000000  0.806837  0.450000  1
  H  H10  1  0.000000  0.164918  0.470000  1
  H  H11  1  0.000000  0.523000  0.490000  1
  H  H12  1  0.000000  0.881081  0.510000  1
  H  H13  1  0.000000  0.239163  0.530000  1
  H  H14  1  0.000000  0.597245  0.550000  1
  H  H15  1  0.000000  0.955326  0.570000  1
  H  H16  1  0.000000  0.313408  0.590000  1
  H  H17  1  0.000000  0.671489  0.610000  1
  H  H18  1  0.000000  0.029571  0.630000  1
  H  H19  1  0.000000  0.387653  0.650000  1
  H  H20  1  0.000000  0.745734  0.670000  1
  H  H21  1  0.000000  0.103816  0.690000  1
  H  H22  1  0.000000  0.461898  0.710000  1
