# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.75108487
_cell_length_b   4.17456385
_cell_length_c   50.84029006
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.52971885
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H48
_cell_volume   988.212612893
_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  0.640317  0.263722  0.269903  1
  H  H2  1  0.177187  0.378448  0.251390  1
  H  H3  1  0.428098  0.818382  0.259354  1
  H  H4  1  0.942690  0.928612  0.242538  1
  H  H5  1  0.528311  -0.018822  0.306961  1
  H  H6  1  1.087207  0.110482  0.288794  1
  H  H7  1  0.310092  0.549239  0.297610  1
  H  H8  1  0.862318  0.682113  0.281110  1
  H  H9  1  0.417970  0.703061  0.343784  1
  H  H10  1  0.973108  0.838839  0.325710  1
  H  H11  1  0.195997  0.272399  0.334503  1
  H  H12  1  0.750975  0.404633  0.316707  1
  H  H13  1  0.306761  0.428679  0.380777  1
  H  H14  1  0.861862  0.564123  0.362456  1
  H  H15  1  1.084812  -0.002973  0.371507  1
  H  H16  1  0.638771  0.132417  0.353289  1
  H  H17  1  0.195999  0.154163  0.417717  1
  H  H18  1  0.751226  0.290446  0.399323  1
  H  H19  1  0.973788  0.722635  0.408479  1
  H  H20  1  0.528721  0.859044  0.390126  1
  H  H21  1  1.085307  0.879941  0.454641  1
  H  H22  1  0.640511  0.016600  0.436227  1
  H  H23  1  0.862992  0.448449  0.445411  1
  H  H24  1  0.418156  0.585117  0.427004  1
  H  H25  1  0.974630  0.605897  0.491550  1
  H  H26  1  0.529794  0.742565  0.473143  1
  H  H27  1  0.752276  0.174414  0.482327  1
  H  H28  1  0.307480  0.311073  0.463913  1
  H  H29  1  0.864065  0.331970  0.528428  1
  H  H30  1  0.418999  0.468379  0.510075  1
  H  H31  1  0.641560  0.900568  0.519231  1
  H  H32  1  0.196787  0.036851  0.500837  1
  H  H33  1  0.754015  0.058597  0.565266  1
  H  H34  1  0.307974  0.193987  0.547047  1
  H  H35  1  0.530925  0.626891  0.556099  1
  H  H36  1  1.086025  0.762335  0.537777  1
  H  H37  1  0.641812  0.786381  0.601848  1
  H  H38  1  0.196789  0.918615  0.584051  1
  H  H39  1  0.419679  0.352175  0.592844  1
  H  H40  1  0.974816  0.487952  0.574770  1
  H  H41  1  0.530469  0.508901  0.637444  1
  H  H42  1  1.082695  0.641775  0.620944  1
  H  H43  1  0.305580  0.080532  0.629760  1
  H  H44  1  0.864476  0.209836  0.611593  1
  H  H45  1  0.450096  0.262402  0.676016  1
  H  H46  1  0.964688  0.372632  0.659200  1
  H  H47  1  0.215599  0.812566  0.667164  1
  H  H48  1  0.752470  0.927292  0.648651  1
