# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.34321032
_cell_length_b   6.25795915
_cell_length_c   32.45083802
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   104.21687786
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H24
_cell_volume   461.275993464
_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  0.714075  0.426175  0.513383  1
  H  H2  1  0.886828  0.798767  0.495155  1
  H  H3  1  0.354837  0.687589  0.554197  1
  H  H4  1  0.543440  0.062052  0.533644  1
  H  H5  1  -0.001573  -0.053611  0.591855  1
  H  H6  1  0.179900  0.318766  0.573194  1
  H  H7  1  0.635368  0.200480  0.630373  1
  H  H8  1  0.816587  0.573809  0.611584  1
  H  H9  1  0.273114  0.455840  0.668556  1
  H  H10  1  0.454545  0.828915  0.649242  1
  H  H11  1  -0.088733  0.711808  0.706808  1
  H  H12  1  0.092151  0.083737  0.687693  1
  H  H13  1  0.549410  -0.032515  0.745175  1
  H  H14  1  0.730294  0.339413  0.726060  1
  H  H15  1  0.187016  0.222306  0.783626  1
  H  H16  1  0.368447  0.595381  0.764312  1
  H  H17  1  0.824974  0.477413  0.821284  1
  H  H18  1  0.006193  0.850741  0.802495  1
  H  H19  1  0.461661  0.732456  0.859674  1
  H  H20  1  0.643134  0.104833  0.841013  1
  H  H21  1  0.098121  -0.010830  0.899224  1
  H  H22  1  0.286724  0.363633  0.878671  1
  H  H23  1  0.754732  0.252455  0.937713  1
  H  H24  1  -0.072514  0.625047  0.919485  1
