# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.22321124
_cell_length_b   22.91976275
_cell_length_c   49.30913332
_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   H120
_cell_volume   2512.57026568
_cell_formula_units_Z   60
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  0.248423  0.299283  0.284908  1
  H  H2  1  0.248423  0.616678  0.313416  1
  H  H3  1  0.248423  0.956601  0.299935  1
  H  H4  1  0.748423  0.044674  0.284765  1
  H  H5  1  0.748423  0.389214  0.270626  1
  H  H6  1  0.748423  0.707901  0.298929  1
  H  H7  1  0.248423  0.116678  0.313416  1
  H  H8  1  0.248423  0.456601  0.299935  1
  H  H9  1  0.248423  0.799283  0.284908  1
  H  H10  1  0.748423  0.207901  0.298929  1
  H  H11  1  0.748423  0.544674  0.284765  1
  H  H12  1  0.748423  0.889214  0.270626  1
  H  H13  1  0.248423  0.276428  0.329400  1
  H  H14  1  0.248423  0.595558  0.358355  1
  H  H15  1  0.248423  0.935717  0.344372  1
  H  H16  1  0.748423  0.025892  0.329629  1
  H  H17  1  0.748423  0.366668  0.315279  1
  H  H18  1  0.748423  0.685789  0.343666  1
  H  H19  1  0.248423  0.095558  0.358355  1
  H  H20  1  0.248423  0.435717  0.344372  1
  H  H21  1  0.248423  0.776428  0.329400  1
  H  H22  1  0.748423  0.185789  0.343666  1
  H  H23  1  0.748423  0.525892  0.329629  1
  H  H24  1  0.748423  0.866668  0.315279  1
  H  H25  1  0.248423  0.254300  0.373612  1
  H  H26  1  0.248423  0.573897  0.403067  1
  H  H27  1  0.248423  0.914159  0.388675  1
  H  H28  1  0.748423  1.004894  0.373790  1
  H  H29  1  0.748423  0.344968  0.359220  1
  H  H30  1  0.748423  0.664021  0.388173  1
  H  H31  1  0.248423  0.073897  0.403067  1
  H  H32  1  0.248423  0.414159  0.388675  1
  H  H33  1  0.248423  0.754300  0.373612  1
  H  H34  1  0.748423  0.164021  0.388173  1
  H  H35  1  0.748423  0.504894  0.373790  1
  H  H36  1  0.748423  0.844968  0.359220  1
  H  H37  1  0.248423  0.232832  0.418034  1
  H  H38  1  0.248423  0.552251  0.447621  1
  H  H39  1  0.248423  0.892536  0.433001  1
  H  H40  1  0.748423  0.983283  0.418145  1
  H  H41  1  0.748423  0.323348  0.403432  1
  H  H42  1  0.748423  0.642580  0.432755  1
  H  H43  1  0.248423  0.052251  0.447621  1
  H  H44  1  0.248423  0.392536  0.433001  1
  H  H45  1  0.248423  0.732832  0.418034  1
  H  H46  1  0.748423  0.142580  0.432755  1
  H  H47  1  0.748423  0.483283  0.418145  1
  H  H48  1  0.748423  0.823348  0.403432  1
  H  H49  1  0.248423  0.211397  0.462501  1
  H  H50  1  0.248423  0.530661  0.492087  1
  H  H51  1  0.248423  0.870942  0.477358  1
  H  H52  1  0.748423  0.961644  0.462527  1
  H  H53  1  0.748423  0.301846  0.447768  1
  H  H54  1  0.748423  0.621077  0.477277  1
  H  H55  1  0.248423  0.030661  0.492087  1
  H  H56  1  0.248423  0.370942  0.477358  1
  H  H57  1  0.248423  0.711397  0.462501  1
  H  H58  1  0.748423  0.121077  0.477277  1
  H  H59  1  0.748423  0.461644  0.462527  1
  H  H60  1  0.748423  0.801846  0.447768  1
  H  H61  1  0.248423  0.189906  0.506988  1
  H  H62  1  0.248423  0.509137  0.536496  1
  H  H63  1  0.248423  0.849339  0.521738  1
  H  H64  1  0.748423  0.940041  0.506907  1
  H  H65  1  0.748423  0.280322  0.492178  1
  H  H66  1  0.748423  0.599587  0.521764  1
  H  H67  1  0.248423  0.009137  0.536496  1
  H  H68  1  0.248423  0.349339  0.521738  1
  H  H69  1  0.248423  0.689906  0.506988  1
  H  H70  1  0.748423  0.099587  0.521764  1
  H  H71  1  0.748423  0.440041  0.506907  1
  H  H72  1  0.748423  0.780322  0.492178  1
  H  H73  1  0.248423  0.168403  0.551510  1
  H  H74  1  0.248423  0.487635  0.580833  1
  H  H75  1  0.248423  0.827700  0.566120  1
  H  H76  1  0.748423  0.918447  0.551264  1
  H  H77  1  0.748423  0.258732  0.536644  1
  H  H78  1  0.748423  0.578151  0.566231  1
  H  H79  1  0.248423  0.987635  0.580833  1
  H  H80  1  0.248423  0.327700  0.566120  1
  H  H81  1  0.248423  0.668403  0.551510  1
  H  H82  1  0.748423  0.078151  0.566231  1
  H  H83  1  0.748423  0.418447  0.551264  1
  H  H84  1  0.748423  0.758732  0.536644  1
  H  H85  1  0.248423  0.146962  0.596091  1
  H  H86  1  0.248423  0.466015  0.625045  1
  H  H87  1  0.248423  0.806089  0.610474  1
  H  H88  1  0.748423  0.896824  0.595590  1
  H  H89  1  0.748423  0.237086  0.581198  1
  H  H90  1  0.748423  0.556683  0.610653  1
  H  H91  1  0.248423  0.966015  0.625045  1
  H  H92  1  0.248423  0.306089  0.610474  1
  H  H93  1  0.248423  0.646962  0.596091  1
  H  H94  1  0.748423  0.056683  0.610653  1
  H  H95  1  0.748423  0.396824  0.595590  1
  H  H96  1  0.748423  0.737086  0.581198  1
  H  H97  1  0.248423  0.125194  0.640599  1
  H  H98  1  0.248423  0.444316  0.668986  1
  H  H99  1  0.248423  0.785091  0.654635  1
  H  H100  1  0.748423  0.875266  0.639892  1
  H  H101  1  0.748423  0.215425  0.625910  1
  H  H102  1  0.748423  0.534555  0.654864  1
  H  H103  1  0.248423  0.944316  0.668986  1
  H  H104  1  0.248423  0.285091  0.654635  1
  H  H105  1  0.248423  0.625194  0.640599  1
  H  H106  1  0.748423  0.034555  0.654864  1
  H  H107  1  0.748423  0.375266  0.639892  1
  H  H108  1  0.748423  0.715425  0.625910  1
  H  H109  1  0.248423  0.103082  0.685336  1
  H  H110  1  0.248423  0.421769  0.713639  1
  H  H111  1  0.248423  0.766309  0.699500  1
  H  H112  1  0.748423  0.854382  0.684330  1
  H  H113  1  0.748423  0.194305  0.670849  1
  H  H114  1  0.748423  0.511700  0.699357  1
  H  H115  1  0.248423  0.921769  0.713639  1
  H  H116  1  0.248423  0.266309  0.699500  1
  H  H117  1  0.248423  0.603082  0.685336  1
  H  H118  1  0.748423  0.011700  0.699357  1
  H  H119  1  0.748423  0.354382  0.684330  1
  H  H120  1  0.748423  0.694305  0.670849  1
