# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.83738196
_cell_length_b   3.97677894
_cell_length_c   47.19313857
_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   H36
_cell_volume   720.187104334
_cell_formula_units_Z   18
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  0.752669  0.935299  0.264376  1
  H  H2  1  0.252669  0.763947  0.287459  1
  H  H3  1  0.752669  0.415689  0.289741  1
  H  H4  1  0.252669  0.254466  0.312542  1
  H  H5  1  0.752669  0.903641  0.315290  1
  H  H6  1  0.252669  0.742341  0.337880  1
  H  H7  1  0.752669  0.393884  0.339865  1
  H  H8  1  0.252669  0.231176  0.362624  1
  H  H9  1  0.752669  0.882998  0.364923  1
  H  H10  1  0.252669  0.720105  0.387754  1
  H  H11  1  0.752669  0.372012  0.389830  1
  H  H12  1  0.252669  0.209314  0.412731  1
  H  H13  1  0.752669  0.861032  0.414880  1
  H  H14  1  0.252669  0.698364  0.437779  1
  H  H15  1  0.752669  0.350131  0.439868  1
  H  H16  1  0.252669  0.187455  0.462781  1
  H  H17  1  0.752669  0.839207  0.464895  1
  H  H18  1  0.252669  0.676518  0.487806  1
  H  H19  1  0.752669  0.328297  0.489899  1
  H  H20  1  0.252669  0.165608  0.512810  1
  H  H21  1  0.752669  0.817360  0.514924  1
  H  H22  1  0.252669  0.654684  0.537837  1
  H  H23  1  0.752669  0.306451  0.539926  1
  H  H24  1  0.252669  0.143783  0.562825  1
  H  H25  1  0.752669  0.795501  0.564974  1
  H  H26  1  0.252669  0.632803  0.587875  1
  H  H27  1  0.752669  0.284709  0.589951  1
  H  H28  1  0.252669  0.121817  0.612782  1
  H  H29  1  0.752669  0.773638  0.615082  1
  H  H30  1  0.252669  0.610931  0.637840  1
  H  H31  1  0.752669  0.262473  0.639826  1
  H  H32  1  0.252669  0.101174  0.662416  1
  H  H33  1  0.752669  0.750348  0.665163  1
  H  H34  1  0.252669  0.589126  0.687964  1
  H  H35  1  0.752669  0.240868  0.690246  1
  H  H36  1  0.252669  0.069516  0.713330  1
