# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.83760016
_cell_length_b   10.69067964
_cell_length_c   58.95962173
_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   2418.91009904
_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  1.005900  0.263013  0.274140  1
  H  H2  1  1.008648  0.096844  0.303673  1
  H  H3  1  1.012018  0.433288  0.242900  1
  H  H4  1  1.008406  0.306191  0.311714  1
  H  H5  1  1.003774  0.639821  0.251802  1
  H  H6  1  1.006562  0.471726  0.281411  1
  H  H7  1  0.894892  0.514829  0.319129  1
  H  H8  1  0.897162  0.845484  0.258329  1
  H  H9  1  0.894636  0.679963  0.289161  1
  H  H10  1  0.898143  0.052999  0.265479  1
  H  H11  1  0.896441  0.888741  0.296329  1
  H  H12  1  0.902724  0.218484  0.235856  1
  H  H13  1  0.509372  0.179963  0.289161  1
  H  H14  1  0.509116  0.014829  0.319129  1
  H  H15  1  0.506846  0.345484  0.258329  1
  H  H16  1  0.507567  0.388741  0.296329  1
  H  H17  1  0.501284  0.718484  0.235856  1
  H  H18  1  0.505865  0.552999  0.265479  1
  H  H19  1  0.391990  0.933288  0.242900  1
  H  H20  1  0.398108  0.763013  0.274140  1
  H  H21  1  0.395360  0.596844  0.303673  1
  H  H22  1  0.400234  0.139821  0.251802  1
  H  H23  1  0.397446  -0.028274  0.281411  1
  H  H24  1  0.395602  0.806191  0.311714  1
  H  H25  1  1.009577  0.766730  0.364597  1
  H  H26  1  1.009256  0.601439  0.394874  1
  H  H27  1  1.008920  0.932047  0.334210  1
  H  H28  1  1.009101  0.810397  0.402489  1
  H  H29  1  1.008918  0.140760  0.341748  1
  H  H30  1  1.008991  -0.024338  0.372150  1
  H  H31  1  0.894837  0.018763  0.410011  1
  H  H32  1  0.894782  0.349405  0.349462  1
  H  H33  1  0.894736  0.183988  0.379674  1
  H  H34  1  0.895147  0.558406  0.357032  1
  H  H35  1  0.894934  0.393016  0.387344  1
  H  H36  1  0.895303  0.723801  0.326836  1
  H  H37  1  0.509272  0.683988  0.379674  1
  H  H38  1  0.509171  0.518763  0.410011  1
  H  H39  1  0.509226  0.849405  0.349462  1
  H  H40  1  0.509074  0.893016  0.387344  1
  H  H41  1  0.508705  0.223801  0.326836  1
  H  H42  1  0.508861  0.058406  0.357032  1
  H  H43  1  0.395088  0.432047  0.334210  1
  H  H44  1  0.394431  0.266730  0.364597  1
  H  H45  1  0.394752  0.101439  0.394874  1
  H  H46  1  0.395089  0.640760  0.341748  1
  H  H47  1  0.395017  0.475662  0.372150  1
  H  H48  1  0.394907  0.310397  0.402489  1
  H  H49  1  1.009165  0.270815  0.455467  1
  H  H50  1  1.009115  0.105516  0.485775  1
  H  H51  1  1.009194  0.436128  0.425181  1
  H  H52  1  1.009194  0.314482  0.493379  1
  H  H53  1  1.009115  0.645093  0.432785  1
  H  H54  1  1.009165  0.479794  0.463093  1
  H  H55  1  0.894884  0.522914  0.500949  1
  H  H56  1  0.894789  0.853470  0.440326  1
  H  H57  1  0.894857  0.688184  0.470632  1
  H  H58  1  0.894857  0.062425  0.447928  1
  H  H59  1  0.894789  0.897139  0.478234  1
  H  H60  1  0.894884  0.227696  0.417611  1
  H  H61  1  0.509151  0.188184  0.470632  1
  H  H62  1  0.509124  0.022914  0.500949  1
  H  H63  1  0.509219  0.353470  0.440326  1
  H  H64  1  0.509219  0.397139  0.478234  1
  H  H65  1  0.509124  0.727696  0.417611  1
  H  H66  1  0.509151  0.562425  0.447928  1
  H  H67  1  0.394814  0.936128  0.425181  1
  H  H68  1  0.394843  0.770815  0.455467  1
  H  H69  1  0.394893  0.605516  0.485775  1
  H  H70  1  0.394893  0.145093  0.432785  1
  H  H71  1  0.394843  -0.020206  0.463093  1
  H  H72  1  0.394814  0.814482  0.493379  1
  H  H73  1  1.008991  0.774947  0.546410  1
  H  H74  1  1.008918  0.609850  0.576812  1
  H  H75  1  1.009101  0.940212  0.516071  1
  H  H76  1  1.008920  0.818562  0.584350  1
  H  H77  1  1.009256  0.149170  0.523686  1
  H  H78  1  1.009577  -0.016121  0.553963  1
  H  H79  1  0.895303  0.026809  0.591724  1
  H  H80  1  0.894934  0.357593  0.531216  1
  H  H81  1  0.895147  0.192203  0.561528  1
  H  H82  1  0.894736  0.566621  0.538886  1
  H  H83  1  0.894782  0.401205  0.569098  1
  H  H84  1  0.894837  0.731847  0.508549  1
  H  H85  1  0.508861  0.692203  0.561528  1
  H  H86  1  0.508705  0.526809  0.591724  1
  H  H87  1  0.509074  0.857593  0.531216  1
  H  H88  1  0.509226  0.901205  0.569098  1
  H  H89  1  0.509171  0.231847  0.508549  1
  H  H90  1  0.509272  0.066621  0.538886  1
  H  H91  1  0.394907  0.440212  0.516071  1
  H  H92  1  0.395017  0.274947  0.546410  1
  H  H93  1  0.395089  0.109850  0.576812  1
  H  H94  1  0.394752  0.649170  0.523686  1
  H  H95  1  0.394431  0.483879  0.553963  1
  H  H96  1  0.395088  0.318562  0.584350  1
  H  H97  1  1.006562  0.278883  0.637149  1
  H  H98  1  1.003774  0.110789  0.666758  1
  H  H99  1  1.008406  0.444418  0.606846  1
  H  H100  1  1.012018  0.317321  0.675660  1
  H  H101  1  1.008648  0.653765  0.614887  1
  H  H102  1  1.005900  0.487596  0.644420  1
  H  H103  1  0.902724  0.532125  0.682704  1
  H  H104  1  0.896441  0.861868  0.622231  1
  H  H105  1  0.898143  0.697611  0.653081  1
  H  H106  1  0.894636  0.070647  0.629399  1
  H  H107  1  0.897162  0.905126  0.660231  1
  H  H108  1  0.894892  0.235781  0.599431  1
  H  H109  1  0.505865  0.197611  0.653081  1
  H  H110  1  0.501284  0.032125  0.682704  1
  H  H111  1  0.507567  0.361868  0.622231  1
  H  H112  1  0.506846  0.405126  0.660231  1
  H  H113  1  0.509116  0.735781  0.599431  1
  H  H114  1  0.509372  0.570647  0.629399  1
  H  H115  1  0.395602  0.944418  0.606846  1
  H  H116  1  0.397446  0.778883  0.637149  1
  H  H117  1  0.400234  0.610789  0.666758  1
  H  H118  1  0.395360  0.153765  0.614887  1
  H  H119  1  0.398108  -0.012404  0.644420  1
  H  H120  1  0.391990  0.817321  0.675660  1
