# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.84866230
_cell_length_b   2.85378036
_cell_length_c   45.81966136
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.25153288
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H19
_cell_volume   324.990247245
_cell_formula_units_Z   9
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  0.000000  0.292077  1
  H  H2  1  0.000000  0.000000  0.313003  1
  H  H3  1  0.000000  0.000000  0.337762  1
  H  H4  1  0.000000  0.000000  0.360466  1
  H  H5  1  0.000000  0.000000  0.384016  1
  H  H6  1  0.000000  0.000000  0.407159  1
  H  H7  1  0.000000  0.000000  0.430487  1
  H  H8  1  0.000000  0.000000  0.453729  1
  H  H9  1  0.000000  0.000000  0.477009  1
  H  H10  1  0.000000  0.000000  0.500274  1
  H  H11  1  0.000000  0.000000  0.523539  1
  H  H12  1  0.000000  0.000000  0.546819  1
  H  H13  1  0.000000  0.000000  0.570061  1
  H  H14  1  0.000000  0.000000  0.593389  1
  H  H15  1  0.000000  0.000000  0.616532  1
  H  H16  1  0.000000  0.000000  0.640082  1
  H  H17  1  0.000000  0.000000  0.662786  1
  H  H18  1  0.000000  0.000000  0.687545  1
  H  H19  1  0.000000  0.000000  0.708471  1
