# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.92894752
_cell_length_b   10.28491753
_cell_length_c   46.89557344
_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   H288
_cell_volume   5753.53543706
_cell_formula_units_Z   144
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  0.119931  0.675174  0.295961  1
  H  H2  1  0.285890  0.744870  0.276496  1
  H  H3  1  0.119224  0.244870  0.276496  1
  H  H4  1  0.453265  0.675174  0.295961  1
  H  H5  1  0.619224  0.744870  0.276496  1
  H  H6  1  0.286598  0.175174  0.295961  1
  H  H7  1  0.452557  0.244870  0.276496  1
  H  H8  1  0.786598  0.675174  0.295961  1
  H  H9  1  0.952557  0.744870  0.276496  1
  H  H10  1  0.619931  0.175174  0.295961  1
  H  H11  1  0.785890  0.244870  0.276496  1
  H  H12  1  0.953265  0.175174  0.295961  1
  H  H13  1  0.065441  0.467642  0.284153  1
  H  H14  1  0.232848  0.390736  0.303477  1
  H  H15  1  0.066181  0.890736  0.303477  1
  H  H16  1  0.398774  0.467642  0.284153  1
  H  H17  1  0.566181  0.390736  0.303477  1
  H  H18  1  0.232107  0.967642  0.284153  1
  H  H19  1  0.399514  0.890736  0.303477  1
  H  H20  1  0.732107  0.467642  0.284153  1
  H  H21  1  0.899514  0.390736  0.303477  1
  H  H22  1  0.565441  0.967642  0.284153  1
  H  H23  1  0.732848  0.890736  0.303477  1
  H  H24  1  0.898774  0.967642  0.284153  1
  H  H25  1  0.116524  0.523948  0.332936  1
  H  H26  1  0.284475  0.598775  0.314706  1
  H  H27  1  0.117808  0.098775  0.314706  1
  H  H28  1  0.449857  0.523948  0.332936  1
  H  H29  1  0.617808  0.598775  0.314706  1
  H  H30  1  0.283190  0.023948  0.332936  1
  H  H31  1  0.451142  0.098775  0.314706  1
  H  H32  1  0.783190  0.523948  0.332936  1
  H  H33  1  0.951142  0.598775  0.314706  1
  H  H34  1  0.616524  0.023948  0.332936  1
  H  H35  1  0.784475  0.098775  0.314706  1
  H  H36  1  0.949857  0.023948  0.332936  1
  H  H37  1  0.065504  0.315139  0.323128  1
  H  H38  1  0.230333  0.239366  0.341618  1
  H  H39  1  0.063666  0.739366  0.341618  1
  H  H40  1  0.398837  0.315139  0.323128  1
  H  H41  1  0.563666  0.239366  0.341618  1
  H  H42  1  0.232170  0.815139  0.323128  1
  H  H43  1  0.396999  0.739366  0.341618  1
  H  H44  1  0.732170  0.315139  0.323128  1
  H  H45  1  0.896999  0.239366  0.341618  1
  H  H46  1  0.565504  0.815139  0.323128  1
  H  H47  1  0.730333  0.739366  0.341618  1
  H  H48  1  0.898837  0.815139  0.323128  1
  H  H49  1  0.115019  0.374676  0.369942  1
  H  H50  1  0.282177  0.448907  0.351329  1
  H  H51  1  0.115510  0.948907  0.351329  1
  H  H52  1  0.448353  0.374676  0.369942  1
  H  H53  1  0.615510  0.448907  0.351329  1
  H  H54  1  0.281686  0.874676  0.369942  1
  H  H55  1  0.448844  0.948907  0.351329  1
  H  H56  1  0.781686  0.374676  0.369942  1
  H  H57  1  0.948844  0.448907  0.351329  1
  H  H58  1  0.615019  0.874676  0.369942  1
  H  H59  1  0.782177  0.948907  0.351329  1
  H  H60  1  0.948353  0.874676  0.369942  1
  H  H61  1  0.061957  0.163828  0.360178  1
  H  H62  1  0.227441  0.088838  0.378588  1
  H  H63  1  0.060774  0.588838  0.378588  1
  H  H64  1  0.395290  0.163828  0.360178  1
  H  H65  1  0.560774  0.088838  0.378588  1
  H  H66  1  0.228624  0.663828  0.360178  1
  H  H67  1  0.394108  0.588838  0.378588  1
  H  H68  1  0.728624  0.163828  0.360178  1
  H  H69  1  0.894108  0.088838  0.378588  1
  H  H70  1  0.561957  0.663828  0.360178  1
  H  H71  1  0.727441  0.588838  0.378588  1
  H  H72  1  0.895290  0.663828  0.360178  1
  H  H73  1  0.114277  0.225611  0.406827  1
  H  H74  1  0.281248  0.300090  0.388392  1
  H  H75  1  0.114581  0.800090  0.388392  1
  H  H76  1  0.447610  0.225611  0.406827  1
  H  H77  1  0.614581  0.300090  0.388392  1
  H  H78  1  0.280943  0.725611  0.406827  1
  H  H79  1  0.447915  0.800090  0.388392  1
  H  H80  1  0.780943  0.225611  0.406827  1
  H  H81  1  0.947915  0.300090  0.388392  1
  H  H82  1  0.614277  0.725611  0.406827  1
  H  H83  1  0.781248  0.800090  0.388392  1
  H  H84  1  0.947610  0.725611  0.406827  1
  H  H85  1  0.060105  0.014103  0.397180  1
  H  H86  1  0.226196  0.939525  0.415744  1
  H  H87  1  0.059529  0.439525  0.415744  1
  H  H88  1  0.393438  0.014103  0.397180  1
  H  H89  1  0.559529  0.939525  0.415744  1
  H  H90  1  0.226772  0.514103  0.397180  1
  H  H91  1  0.392863  0.439525  0.415744  1
  H  H92  1  0.726772  0.014103  0.397180  1
  H  H93  1  0.892863  0.939525  0.415744  1
  H  H94  1  0.560105  0.514103  0.397180  1
  H  H95  1  0.726196  0.439525  0.415744  1
  H  H96  1  0.893438  0.514103  0.397180  1
  H  H97  1  0.113718  0.076842  0.443692  1
  H  H98  1  0.280643  0.151192  0.425220  1
  H  H99  1  0.113976  0.651192  0.425220  1
  H  H100  1  0.447052  0.076842  0.443692  1
  H  H101  1  0.613976  0.151192  0.425220  1
  H  H102  1  0.280385  0.576842  0.443692  1
  H  H103  1  0.447309  0.651192  0.425220  1
  H  H104  1  0.780385  0.076842  0.443692  1
  H  H105  1  0.947309  0.151192  0.425220  1
  H  H106  1  0.613718  0.576842  0.443692  1
  H  H107  1  0.780643  0.651192  0.425220  1
  H  H108  1  0.947052  0.576842  0.443692  1
  H  H109  1  0.059119  0.864884  0.434261  1
  H  H110  1  0.225474  0.790309  0.452748  1
  H  H111  1  0.058808  0.290309  0.452748  1
  H  H112  1  0.392453  0.864884  0.434261  1
  H  H113  1  0.558808  0.790309  0.452748  1
  H  H114  1  0.225786  0.364884  0.434261  1
  H  H115  1  0.392141  0.290309  0.452748  1
  H  H116  1  0.725786  0.864884  0.434261  1
  H  H117  1  0.892141  0.790309  0.452748  1
  H  H118  1  0.559119  0.364884  0.434261  1
  H  H119  1  0.725474  0.290309  0.452748  1
  H  H120  1  0.892453  0.364884  0.434261  1
  H  H121  1  0.113352  0.928035  0.480610  1
  H  H122  1  0.280191  1.002468  0.462146  1
  H  H123  1  0.113524  0.502468  0.462146  1
  H  H124  1  0.446685  0.928035  0.480610  1
  H  H125  1  0.613524  1.002468  0.462146  1
  H  H126  1  0.280019  0.428035  0.480610  1
  H  H127  1  0.446858  0.502468  0.462146  1
  H  H128  1  0.780019  0.928035  0.480610  1
  H  H129  1  0.946858  1.002468  0.462146  1
  H  H130  1  0.613352  0.428035  0.480610  1
  H  H131  1  0.780191  0.502468  0.462146  1
  H  H132  1  0.946685  0.428035  0.480610  1
  H  H133  1  0.058598  0.715798  0.471219  1
  H  H134  1  0.225077  0.641343  0.489697  1
  H  H135  1  0.058410  0.141343  0.489697  1
  H  H136  1  0.391931  0.715798  0.471219  1
  H  H137  1  0.558410  0.641343  0.489697  1
  H  H138  1  0.225264  0.215798  0.471219  1
  H  H139  1  0.391744  0.141343  0.489697  1
  H  H140  1  0.725264  0.715798  0.471219  1
  H  H141  1  0.891744  0.641343  0.489697  1
  H  H142  1  0.558598  0.215798  0.471219  1
  H  H143  1  0.725077  0.141343  0.489697  1
  H  H144  1  0.891931  0.215798  0.471219  1
  H  H145  1  0.113001  0.779140  0.517547  1
  H  H146  1  0.279855  0.853595  0.499069  1
  H  H147  1  0.113188  0.353595  0.499069  1
  H  H148  1  0.446334  0.779140  0.517547  1
  H  H149  1  0.613188  0.853595  0.499069  1
  H  H150  1  0.279668  0.279140  0.517547  1
  H  H151  1  0.446521  0.353595  0.499069  1
  H  H152  1  0.779668  0.779140  0.517547  1
  H  H153  1  0.946521  0.853595  0.499069  1
  H  H154  1  0.613001  0.279140  0.517547  1
  H  H155  1  0.779855  0.353595  0.499069  1
  H  H156  1  0.946334  0.279140  0.517547  1
  H  H157  1  0.058246  0.566902  0.508156  1
  H  H158  1  0.224741  0.492470  0.526620  1
  H  H159  1  0.058074  0.992470  0.526620  1
  H  H160  1  0.391580  0.566902  0.508156  1
  H  H161  1  0.558074  0.492470  0.526620  1
  H  H162  1  0.224913  0.066902  0.508156  1
  H  H163  1  0.391408  0.992470  0.526620  1
  H  H164  1  0.724913  0.566902  0.508156  1
  H  H165  1  0.891408  0.492470  0.526620  1
  H  H166  1  0.558246  0.066902  0.508156  1
  H  H167  1  0.724741  0.992470  0.526620  1
  H  H168  1  0.891580  0.066902  0.508156  1
  H  H169  1  0.112479  0.630054  0.554505  1
  H  H170  1  0.279458  0.704629  0.536018  1
  H  H171  1  0.112791  0.204629  0.536018  1
  H  H172  1  0.445812  0.630054  0.554505  1
  H  H173  1  0.612791  0.704629  0.536018  1
  H  H174  1  0.279146  0.130054  0.554505  1
  H  H175  1  0.446124  0.204629  0.536018  1
  H  H176  1  0.779146  0.630054  0.554505  1
  H  H177  1  0.946124  0.704629  0.536018  1
  H  H178  1  0.612479  0.130054  0.554505  1
  H  H179  1  0.779458  0.204629  0.536018  1
  H  H180  1  0.945812  0.130054  0.554505  1
  H  H181  1  0.057880  0.418095  0.545074  1
  H  H182  1  0.224289  0.343746  0.563546  1
  H  H183  1  0.057622  0.843746  0.563546  1
  H  H184  1  0.391214  0.418095  0.545074  1
  H  H185  1  0.557622  0.343746  0.563546  1
  H  H186  1  0.224547  0.918095  0.545074  1
  H  H187  1  0.390956  0.843746  0.563546  1
  H  H188  1  0.724547  0.418095  0.545074  1
  H  H189  1  0.890956  0.343746  0.563546  1
  H  H190  1  0.557880  0.918095  0.545074  1
  H  H191  1  0.724289  0.843746  0.563546  1
  H  H192  1  0.891214  0.918095  0.545074  1
  H  H193  1  0.111494  0.480834  0.591586  1
  H  H194  1  0.278736  0.555413  0.573022  1
  H  H195  1  0.112069  0.055413  0.573022  1
  H  H196  1  0.444827  0.480834  0.591586  1
  H  H197  1  0.612069  0.555413  0.573022  1
  H  H198  1  0.278160  0.980834  0.591586  1
  H  H199  1  0.445403  0.055413  0.573022  1
  H  H200  1  0.778160  0.480834  0.591586  1
  H  H201  1  0.945403  0.555413  0.573022  1
  H  H202  1  0.611494  0.980834  0.591586  1
  H  H203  1  0.778736  0.055413  0.573022  1
  H  H204  1  0.944827  0.980834  0.591586  1
  H  H205  1  0.057322  0.269327  0.581939  1
  H  H206  1  0.223684  0.194847  0.600374  1
  H  H207  1  0.057017  0.694847  0.600374  1
  H  H208  1  0.390655  0.269327  0.581939  1
  H  H209  1  0.557017  0.194847  0.600374  1
  H  H210  1  0.223989  0.769327  0.581939  1
  H  H211  1  0.390351  0.694847  0.600374  1
  H  H212  1  0.723989  0.269327  0.581939  1
  H  H213  1  0.890351  0.194847  0.600374  1
  H  H214  1  0.557322  0.769327  0.581939  1
  H  H215  1  0.723684  0.694847  0.600374  1
  H  H216  1  0.890655  0.769327  0.581939  1
  H  H217  1  0.109642  0.331110  0.628588  1
  H  H218  1  0.277491  0.406100  0.610178  1
  H  H219  1  0.110824  0.906100  0.610178  1
  H  H220  1  0.442975  0.331110  0.628588  1
  H  H221  1  0.610824  0.406100  0.610178  1
  H  H222  1  0.276308  0.831110  0.628588  1
  H  H223  1  0.444158  0.906100  0.610178  1
  H  H224  1  0.776308  0.331110  0.628588  1
  H  H225  1  0.944158  0.406100  0.610178  1
  H  H226  1  0.609642  0.831110  0.628588  1
  H  H227  1  0.777491  0.906100  0.610178  1
  H  H228  1  0.942975  0.831110  0.628588  1
  H  H229  1  0.056579  0.120262  0.618823  1
  H  H230  1  0.222755  0.046031  0.637437  1
  H  H231  1  0.056088  0.546031  0.637437  1
  H  H232  1  0.389913  0.120262  0.618823  1
  H  H233  1  0.556088  0.046031  0.637437  1
  H  H234  1  0.223246  0.620262  0.618823  1
  H  H235  1  0.389421  0.546031  0.637437  1
  H  H236  1  0.723246  0.120262  0.618823  1
  H  H237  1  0.889421  0.046031  0.637437  1
  H  H238  1  0.556579  0.620262  0.618823  1
  H  H239  1  0.722755  0.546031  0.637437  1
  H  H240  1  0.889913  0.620262  0.618823  1
  H  H241  1  0.106095  0.179798  0.665638  1
  H  H242  1  0.274599  0.255572  0.647148  1
  H  H243  1  0.107933  0.755572  0.647148  1
  H  H244  1  0.439428  0.179798  0.665638  1
  H  H245  1  0.607933  0.255572  0.647148  1
  H  H246  1  0.272762  0.679798  0.665638  1
  H  H247  1  0.441266  0.755572  0.647148  1
  H  H248  1  0.772762  0.179798  0.665638  1
  H  H249  1  0.941266  0.255572  0.647148  1
  H  H250  1  0.606095  0.679798  0.665638  1
  H  H251  1  0.774599  0.755572  0.647148  1
  H  H252  1  0.939428  0.679798  0.665638  1
  H  H253  1  0.055075  0.970990  0.655830  1
  H  H254  1  0.220457  0.896163  0.674059  1
  H  H255  1  0.053790  0.396163  0.674059  1
  H  H256  1  0.388408  0.970990  0.655830  1
  H  H257  1  0.553790  0.896163  0.674059  1
  H  H258  1  0.221742  0.470990  0.655830  1
  H  H259  1  0.387124  0.396163  0.674059  1
  H  H260  1  0.721742  0.970990  0.655830  1
  H  H261  1  0.887124  0.896163  0.674059  1
  H  H262  1  0.555075  0.470990  0.655830  1
  H  H263  1  0.720457  0.396163  0.674059  1
  H  H264  1  0.888408  0.470990  0.655830  1
  H  H265  1  0.106158  0.027296  0.704613  1
  H  H266  1  0.272084  0.104201  0.685289  1
  H  H267  1  0.105417  0.604201  0.685289  1
  H  H268  1  0.439491  0.027296  0.704613  1
  H  H269  1  0.605417  0.104201  0.685289  1
  H  H270  1  0.272825  0.527296  0.704613  1
  H  H271  1  0.438751  0.604201  0.685289  1
  H  H272  1  0.772825  0.027296  0.704613  1
  H  H273  1  0.938751  0.104201  0.685289  1
  H  H274  1  0.606158  0.527296  0.704613  1
  H  H275  1  0.772084  0.604201  0.685289  1
  H  H276  1  0.939491  0.527296  0.704613  1
  H  H277  1  0.051667  0.819764  0.692805  1
  H  H278  1  0.219042  0.750068  0.712269  1
  H  H279  1  0.052375  0.250068  0.712269  1
  H  H280  1  0.385001  0.819764  0.692805  1
  H  H281  1  0.552375  0.750068  0.712269  1
  H  H282  1  0.218334  0.319764  0.692805  1
  H  H283  1  0.385708  0.250068  0.712269  1
  H  H284  1  0.718334  0.819764  0.692805  1
  H  H285  1  0.885708  0.750068  0.712269  1
  H  H286  1  0.551667  0.319764  0.692805  1
  H  H287  1  0.719042  0.250068  0.712269  1
  H  H288  1  0.885001  0.319764  0.692805  1
