# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.35569100
_cell_length_b   14.06308537
_cell_length_c   47.77911142
_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   H48
_cell_volume   4270.52684601
_cell_formula_units_Z   24
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  0.250000  0.557692  0.271242  1
  H  H2  1  0.250000  0.096154  0.310458  1
  H  H3  1  0.250000  0.826923  0.290850  1
  H  H4  1  0.750000  0.519231  0.316993  1
  H  H5  1  0.750000  0.250000  0.297386  1
  H  H6  1  0.750000  0.980769  0.277778  1
  H  H7  1  0.250000  0.365385  0.330065  1
  H  H8  1  0.250000  0.903846  0.369281  1
  H  H9  1  0.250000  0.634615  0.349673  1
  H  H10  1  0.750000  0.326923  0.375817  1
  H  H11  1  0.750000  0.057692  0.356209  1
  H  H12  1  0.750000  0.788462  0.336601  1
  H  H13  1  0.250000  0.173077  0.388889  1
  H  H14  1  0.250000  0.711538  0.428105  1
  H  H15  1  0.250000  0.442308  0.408497  1
  H  H16  1  0.750000  0.134615  0.434641  1
  H  H17  1  0.750000  0.865385  0.415033  1
  H  H18  1  0.750000  0.596154  0.395425  1
  H  H19  1  0.250000  0.980769  0.447712  1
  H  H20  1  0.250000  0.519231  0.486928  1
  H  H21  1  0.250000  0.250000  0.467320  1
  H  H22  1  0.750000  0.942308  0.493464  1
  H  H23  1  0.750000  0.673077  0.473856  1
  H  H24  1  0.750000  0.403846  0.454248  1
  H  H25  1  0.250000  0.788462  0.506536  1
  H  H26  1  0.250000  0.326923  0.545752  1
  H  H27  1  0.250000  0.057692  0.526144  1
  H  H28  1  0.750000  0.750000  0.552288  1
  H  H29  1  0.750000  0.480769  0.532680  1
  H  H30  1  0.750000  0.211538  0.513072  1
  H  H31  1  0.250000  0.596154  0.565359  1
  H  H32  1  0.250000  0.134615  0.604575  1
  H  H33  1  0.250000  0.865385  0.584967  1
  H  H34  1  0.750000  0.557692  0.611111  1
  H  H35  1  0.750000  0.288462  0.591503  1
  H  H36  1  0.750000  0.019231  0.571895  1
  H  H37  1  0.250000  0.403846  0.624183  1
  H  H38  1  0.250000  0.942308  0.663399  1
  H  H39  1  0.250000  0.673077  0.643791  1
  H  H40  1  0.750000  0.365385  0.669935  1
  H  H41  1  0.750000  0.096154  0.650327  1
  H  H42  1  0.750000  0.826923  0.630719  1
  H  H43  1  0.250000  0.211538  0.683007  1
  H  H44  1  0.250000  0.750000  0.722222  1
  H  H45  1  0.250000  0.480769  0.702614  1
  H  H46  1  0.750000  0.173077  0.728758  1
  H  H47  1  0.750000  0.903846  0.709150  1
  H  H48  1  0.750000  0.634615  0.689542  1
