# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.27243644
_cell_length_b   10.08080254
_cell_length_c   58.18914818
_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   1332.99602035
_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  1.017896  1.123487  0.282533  1
  H  H2  1  1.017896  0.855359  0.336362  1
  H  H3  1  0.517896  1.033991  0.250133  1
  H  H4  1  0.517896  0.765478  0.304302  1
  H  H5  1  1.017896  0.835220  0.239332  1
  H  H6  1  1.017896  0.568787  0.293225  1
  H  H7  1  0.517896  0.211241  0.314725  1
  H  H8  1  0.517896  0.478622  0.261203  1
  H  H9  1  0.517896  0.989355  0.309415  1
  H  H10  1  0.517896  0.258783  0.254791  1
  H  H11  1  1.017896  0.899643  0.277443  1
  H  H12  1  1.017896  0.631358  0.331133  1
  H  H13  1  0.517896  0.703289  0.266699  1
  H  H14  1  0.517896  0.435031  0.319991  1
  H  H15  1  1.017896  0.609203  0.234153  1
  H  H16  1  1.017896  0.344537  0.287940  1
  H  H17  1  1.017896  0.587386  0.390137  1
  H  H18  1  1.017896  0.319552  0.443920  1
  H  H19  1  0.517896  0.497443  0.357989  1
  H  H20  1  0.517896  0.229668  0.411767  1
  H  H21  1  1.017896  0.301254  0.346876  1
  H  H22  1  1.017896  1.033465  0.400675  1
  H  H23  1  0.517896  0.675723  0.422304  1
  H  H24  1  0.517896  0.943598  0.368526  1
  H  H25  1  0.517896  0.453467  0.417028  1
  H  H26  1  0.517896  0.721340  0.363253  1
  H  H27  1  1.017896  0.363565  0.384874  1
  H  H28  1  1.017896  1.095752  0.438660  1
  H  H29  1  0.517896  0.167378  0.373776  1
  H  H30  1  0.517896  0.899533  0.427566  1
  H  H31  1  1.017896  1.077485  0.341615  1
  H  H32  1  1.017896  0.809654  0.395416  1
  H  H33  1  1.017896  1.051704  0.497700  1
  H  H34  1  1.017896  0.783873  0.551501  1
  H  H35  1  0.517896  0.961825  0.465550  1
  H  H36  1  0.517896  0.693980  0.519341  1
  H  H37  1  1.017896  0.765606  0.454456  1
  H  H38  1  1.017896  0.497792  0.508242  1
  H  H39  1  0.517896  0.140018  0.529863  1
  H  H40  1  0.517896  0.407891  0.476089  1
  H  H41  1  0.517896  0.917760  0.524590  1
  H  H42  1  0.517896  0.185635  0.470812  1
  H  H43  1  1.017896  0.827893  0.492441  1
  H  H44  1  1.017896  0.560104  0.546241  1
  H  H45  1  0.517896  0.631690  0.481350  1
  H  H46  1  0.517896  0.363915  0.535127  1
  H  H47  1  1.017896  0.541805  0.449196  1
  H  H48  1  1.017896  0.273972  0.502979  1
  H  H49  1  1.017896  0.516821  0.605176  1
  H  H50  1  1.017896  0.252155  0.658964  1
  H  H51  1  0.517896  0.426327  0.573126  1
  H  H52  1  0.517896  0.158068  0.626417  1
  H  H53  1  1.017896  0.230000  0.561984  1
  H  H54  1  1.017896  0.961715  0.615673  1
  H  H55  1  0.517896  0.602575  0.638325  1
  H  H56  1  0.517896  0.872002  0.583701  1
  H  H57  1  0.517896  0.382736  0.631914  1
  H  H58  1  0.517896  0.650117  0.578391  1
  H  H59  1  1.017896  0.292571  0.599891  1
  H  H60  1  1.017896  1.026138  0.653784  1
  H  H61  1  0.517896  1.095880  0.588814  1
  H  H62  1  0.517896  0.827367  0.642984  1
  H  H63  1  1.017896  1.005999  0.556754  1
  H  H64  1  1.017896  0.737871  0.610584  1
