# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.26772588
_cell_length_b   5.73010758
_cell_length_c   44.05577340
_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   H27
_cell_volume   572.474519748
_cell_formula_units_Z   13
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  0.695092  0.120876  0.351895  1
  H  H2  1  0.195092  0.781076  0.368203  1
  H  H3  1  0.195092  0.471757  0.336699  1
  H  H4  1  0.195092  0.095436  0.399591  1
  H  H5  1  0.695092  0.752002  0.415146  1
  H  H6  1  0.695092  0.436195  0.384203  1
  H  H7  1  0.695092  0.066514  0.446495  1
  H  H8  1  0.195092  0.723884  0.462183  1
  H  H9  1  0.195092  0.409404  0.430909  1
  H  H10  1  0.195092  0.038114  0.493549  1
  H  H11  1  0.695092  0.695261  0.509231  1
  H  H12  1  0.695092  0.380894  0.477887  1
  H  H13  1  0.695092  1.009552  0.540598  1
  H  H14  1  0.195092  0.666715  0.556273  1
  H  H15  1  0.195092  0.352390  0.524922  1
  H  H16  1  0.195092  0.980991  0.587646  1
  H  H17  1  0.695092  0.638210  0.603308  1
  H  H18  1  0.695092  0.323843  0.571965  1
  H  H19  1  0.695092  0.952590  0.634701  1
  H  H20  1  0.195092  0.609700  0.650287  1
  H  H21  1  0.195092  0.295220  0.619012  1
  H  H22  1  0.195092  0.923669  0.681604  1
  H  H23  1  0.695092  0.582909  0.696992  1
  H  H24  1  0.695092  0.267102  0.666049  1
  H  H25  1  0.695092  0.898228  0.729300  1
  H  H26  1  0.195092  0.547347  0.744496  1
  H  H27  1  0.195092  0.238029  0.712992  1
