# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.27414537
_cell_length_b   10.11554934
_cell_length_c   58.22880895
_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   H64
_cell_volume   1339.5088964
_cell_formula_units_Z   32
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  1.018406  1.121862  0.282980  1
  H  H2  1  1.018406  0.853558  0.336836  1
  H  H3  1  0.518406  1.032607  0.250551  1
  H  H4  1  0.518406  0.763932  0.304751  1
  H  H5  1  1.018406  0.833317  0.239851  1
  H  H6  1  1.018406  0.566563  0.293738  1
  H  H7  1  0.518406  0.209117  0.315225  1
  H  H8  1  0.518406  0.476656  0.261680  1
  H  H9  1  0.518406  0.987657  0.309879  1
  H  H10  1  0.518406  0.257252  0.255234  1
  H  H11  1  1.018406  0.898189  0.277884  1
  H  H12  1  1.018406  0.629705  0.331582  1
  H  H13  1  0.518406  0.701198  0.267218  1
  H  H14  1  0.518406  0.432727  0.320512  1
  H  H15  1  1.018406  0.607506  0.234660  1
  H  H16  1  1.018406  0.342484  0.288427  1
  H  H17  1  1.018406  0.585388  0.390624  1
  H  H18  1  1.018406  0.317371  0.444426  1
  H  H19  1  0.518406  0.495701  0.358445  1
  H  H20  1  0.518406  0.227747  0.412242  1
  H  H21  1  1.018406  0.298869  0.347408  1
  H  H22  1  1.018406  1.030896  0.401227  1
  H  H23  1  0.518406  0.673226  0.422842  1
  H  H24  1  0.518406  0.941291  0.369049  1
  H  H25  1  0.518406  0.451377  0.417524  1
  H  H26  1  0.518406  0.719435  0.363732  1
  H  H27  1  1.018406  0.361736  0.385340  1
  H  H28  1  1.018406  1.093738  0.439144  1
  H  H29  1  0.518406  0.164903  0.374319  1
  H  H30  1  0.518406  0.896870  0.428126  1
  H  H31  1  1.018406  1.075276  0.342128  1
  H  H32  1  1.018406  0.807250  0.395946  1
  H  H33  1  1.018406  1.049337  0.498223  1
  H  H34  1  1.018406  0.781312  0.552041  1
  H  H35  1  0.518406  0.959718  0.466043  1
  H  H36  1  0.518406  0.691684  0.519850  1
  H  H37  1  1.018406  0.762849  0.455025  1
  H  H38  1  1.018406  0.494852  0.508829  1
  H  H39  1  0.518406  0.137152  0.530437  1
  H  H40  1  0.518406  0.405210  0.476645  1
  H  H41  1  0.518406  0.915296  0.525120  1
  H  H42  1  0.518406  0.183361  0.471327  1
  H  H43  1  1.018406  0.825691  0.492942  1
  H  H44  1  1.018406  0.557718  0.546761  1
  H  H45  1  0.518406  0.628840  0.481927  1
  H  H46  1  0.518406  0.360887  0.535724  1
  H  H47  1  1.018406  0.539216  0.449743  1
  H  H48  1  1.018406  0.271200  0.503545  1
  H  H49  1  1.018406  0.514103  0.605741  1
  H  H50  1  1.018406  0.249081  0.659509  1
  H  H51  1  0.518406  0.423861  0.573657  1
  H  H52  1  0.518406  0.155390  0.626951  1
  H  H53  1  1.018406  0.226882  0.562587  1
  H  H54  1  1.018406  0.958398  0.616285  1
  H  H55  1  0.518406  0.599335  0.638935  1
  H  H56  1  0.518406  0.868930  0.584290  1
  H  H57  1  0.518406  0.379931  0.632489  1
  H  H58  1  0.518406  0.647470  0.578944  1
  H  H59  1  1.018406  0.290024  0.600431  1
  H  H60  1  1.018406  1.023270  0.654318  1
  H  H61  1  0.518406  1.092655  0.589418  1
  H  H62  1  0.518406  0.823980  0.643618  1
  H  H63  1  1.018406  1.003029  0.557333  1
  H  H64  1  1.018406  0.734725  0.611189  1
