# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.09158631
_cell_length_b   6.00571041
_cell_length_c   44.48105573
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   67.94539573
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H60
_cell_volume   1260.63973248
_cell_formula_units_Z   30
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  0.841513  0.018006  0.340951  1
  H  H2  1  0.918067  0.616611  0.328400  1
  H  H3  1  0.453039  0.924983  0.322091  1
  H  H4  1  0.734507  0.407654  0.357261  1
  H  H5  1  0.642187  0.803198  0.371002  1
  H  H6  1  0.374797  0.320098  0.335313  1
  H  H7  1  0.281996  0.707406  0.351075  1
  H  H8  1  0.547198  0.190526  0.384592  1
  H  H9  1  0.452697  0.580941  0.398893  1
  H  H10  1  0.184952  0.107938  0.364498  1
  H  H11  1  0.091576  0.495553  0.378654  1
  H  H12  1  0.356235  0.971127  0.412291  1
  H  H13  1  0.263158  0.359484  0.426172  1
  H  H14  1  -0.002499  0.888208  0.391677  1
  H  H15  1  0.901961  0.276879  0.405852  1
  H  H16  1  0.166788  0.750847  0.439745  1
  H  H17  1  0.072650  0.140178  0.453646  1
  H  H18  1  0.808803  0.666995  0.419327  1
  H  H19  1  0.713850  0.056137  0.432907  1
  H  H20  1  -0.021724  0.530143  0.467291  1
  H  H21  1  0.883225  0.920153  0.481027  1
  H  H22  1  0.619583  0.445990  0.446896  1
  H  H23  1  0.524794  0.835773  0.460411  1
  H  H24  1  0.788950  0.309796  0.494853  1
  H  H25  1  0.694185  0.699683  0.508498  1
  H  H26  1  0.430907  0.224988  0.474250  1
  H  H27  1  0.335698  0.615288  0.487935  1
  H  H28  1  0.599878  0.089240  0.522303  1
  H  H29  1  0.505040  0.479193  0.536019  1
  H  H30  1  0.241497  1.004732  0.501700  1
  H  H31  1  0.147035  0.394443  0.515424  1
  H  H32  1  0.410578  0.868903  0.549743  1
  H  H33  1  0.316377  0.258348  0.563508  1
  H  H34  1  0.052197  0.784396  0.529139  1
  H  H35  1  -0.042111  0.173953  0.542945  1
  H  H36  1  0.221168  0.648648  0.577192  1
  H  H37  1  0.127281  0.037862  0.591032  1
  H  H38  1  0.863125  0.563840  0.556590  1
  H  H39  1  0.768850  0.953483  0.570416  1
  H  H40  1  0.032492  0.427646  0.604547  1
  H  H41  1  0.938225  0.817499  0.618536  1
  H  H42  1  0.673799  0.343493  0.584152  1
  H  H43  1  0.579425  0.733458  0.597797  1
  H  H44  1  0.843272  0.206641  0.632116  1
  H  H45  1  0.750114  0.596756  0.645591  1
  H  H46  1  0.485287  0.122788  0.611698  1
  H  H47  1  0.388917  0.514152  0.625270  1
  H  H48  1  0.654574  0.985428  0.659766  1
  H  H49  1  0.560499  0.378083  0.672789  1
  H  H50  1  0.295840  0.902509  0.639152  1
  H  H51  1  0.199378  0.292695  0.652550  1
  H  H52  1  0.467123  0.765698  0.686945  1
  H  H53  1  0.370079  0.166230  0.700368  1
  H  H54  1  0.104877  0.683110  0.666851  1
  H  H55  1  0.009888  0.070438  0.680441  1
  H  H56  1  0.277278  0.553538  0.716130  1
  H  H57  1  0.199036  0.948653  0.729352  1
  H  H58  1  0.917568  0.465982  0.694182  1
  H  H59  1  0.810562  0.855630  0.710491  1
  H  H60  1  0.734008  0.257025  0.723043  1
