# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.31997594
_cell_length_b   15.39008092
_cell_length_c   55.37533507
_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   H480
_cell_volume   9647.2331413
_cell_formula_units_Z   240
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  0.122027  0.219025  0.218270  1
  H  H2  1  0.289111  0.246483  0.195336  1
  H  H3  1  0.122444  0.746483  0.195336  1
  H  H4  1  0.455360  0.219025  0.218270  1
  H  H5  1  0.622444  0.246483  0.195336  1
  H  H6  1  0.288694  0.719025  0.218270  1
  H  H7  1  0.455778  0.746483  0.195336  1
  H  H8  1  0.788694  0.219025  0.218270  1
  H  H9  1  0.955778  0.246483  0.195336  1
  H  H10  1  0.622027  0.719025  0.218270  1
  H  H11  1  0.789111  0.746483  0.195336  1
  H  H12  1  0.955360  0.719025  0.218270  1
  H  H13  1  0.094371  0.465492  0.230455  1
  H  H14  1  0.262855  0.481653  0.205824  1
  H  H15  1  0.096188  0.981653  0.205824  1
  H  H16  1  0.427704  0.465492  0.230455  1
  H  H17  1  0.596188  0.481653  0.205824  1
  H  H18  1  0.261037  0.965492  0.230455  1
  H  H19  1  0.429521  0.981653  0.205824  1
  H  H20  1  0.761037  0.465492  0.230455  1
  H  H21  1  0.929521  0.481653  0.205824  1
  H  H22  1  0.594371  0.965492  0.230455  1
  H  H23  1  0.762855  0.981653  0.205824  1
  H  H24  1  0.927704  0.965492  0.230455  1
  H  H25  1  0.094847  0.599882  0.211167  1
  H  H26  1  0.259844  0.585884  0.235779  1
  H  H27  1  0.093177  0.085884  0.235779  1
  H  H28  1  0.428181  0.599882  0.211167  1
  H  H29  1  0.593177  0.585884  0.235779  1
  H  H30  1  0.261514  0.099882  0.211167  1
  H  H31  1  0.426510  0.085884  0.235779  1
  H  H32  1  0.761514  0.599882  0.211167  1
  H  H33  1  0.926510  0.585884  0.235779  1
  H  H34  1  0.594847  0.099882  0.211167  1
  H  H35  1  0.759844  0.085884  0.235779  1
  H  H36  1  0.928181  0.099882  0.211167  1
  H  H37  1  0.120979  0.359658  0.200987  1
  H  H38  1  0.288712  0.346631  0.225327  1
  H  H39  1  0.122045  0.846631  0.225327  1
  H  H40  1  0.454312  0.359658  0.200987  1
  H  H41  1  0.622045  0.346631  0.225327  1
  H  H42  1  0.287646  0.859658  0.200987  1
  H  H43  1  0.455378  0.846631  0.225327  1
  H  H44  1  0.787646  0.359658  0.200987  1
  H  H45  1  0.955378  0.346631  0.225327  1
  H  H46  1  0.620979  0.859658  0.200987  1
  H  H47  1  0.788712  0.846631  0.225327  1
  H  H48  1  0.954312  0.859658  0.200987  1
  H  H49  1  0.123148  0.194210  0.263808  1
  H  H50  1  0.289229  0.208013  0.241063  1
  H  H51  1  0.122562  0.708013  0.241063  1
  H  H52  1  0.456481  0.194210  0.263808  1
  H  H53  1  0.622562  0.208013  0.241063  1
  H  H54  1  0.289814  0.694210  0.263808  1
  H  H55  1  0.455895  0.708013  0.241063  1
  H  H56  1  0.789814  0.194210  0.263808  1
  H  H57  1  0.955895  0.208013  0.241063  1
  H  H58  1  0.623148  0.694210  0.263808  1
  H  H59  1  0.789229  0.708013  0.241063  1
  H  H60  1  0.956481  0.694210  0.263808  1
  H  H61  1  0.092301  0.437257  0.275166  1
  H  H62  1  0.259342  0.452143  0.253054  1
  H  H63  1  0.092675  0.952143  0.253054  1
  H  H64  1  0.425634  0.437257  0.275166  1
  H  H65  1  0.592675  0.452143  0.253054  1
  H  H66  1  0.258967  0.937257  0.275166  1
  H  H67  1  0.426008  0.952143  0.253054  1
  H  H68  1  0.758967  0.437257  0.275166  1
  H  H69  1  0.926008  0.452143  0.253054  1
  H  H70  1  0.592301  0.937257  0.275166  1
  H  H71  1  0.759342  0.952143  0.253054  1
  H  H72  1  0.925634  0.937257  0.275166  1
  H  H73  1  0.092491  0.573430  0.258339  1
  H  H74  1  0.258742  0.559787  0.280972  1
  H  H75  1  0.092075  1.059787  0.280972  1
  H  H76  1  0.425825  0.573430  0.258339  1
  H  H77  1  0.592075  0.559787  0.280972  1
  H  H78  1  0.259158  1.073430  0.258339  1
  H  H79  1  0.425409  1.059787  0.280972  1
  H  H80  1  0.759158  0.573430  0.258339  1
  H  H81  1  0.925409  0.559787  0.280972  1
  H  H82  1  0.592491  1.073430  0.258339  1
  H  H83  1  0.758742  1.059787  0.280972  1
  H  H84  1  0.925825  1.073430  0.258339  1
  H  H85  1  0.123039  0.328499  0.246884  1
  H  H86  1  0.290175  0.316045  0.269511  1
  H  H87  1  0.123508  0.816045  0.269511  1
  H  H88  1  0.456372  0.328499  0.246884  1
  H  H89  1  0.623508  0.316045  0.269511  1
  H  H90  1  0.289705  0.828499  0.246884  1
  H  H91  1  0.456842  0.816045  0.269511  1
  H  H92  1  0.789705  0.328499  0.246884  1
  H  H93  1  0.956842  0.316045  0.269511  1
  H  H94  1  0.623039  0.828499  0.246884  1
  H  H95  1  0.790175  0.816045  0.269511  1
  H  H96  1  0.956372  0.828499  0.246884  1
  H  H97  1  0.123966  0.167382  0.309044  1
  H  H98  1  0.290291  0.181082  0.286387  1
  H  H99  1  0.123624  0.681082  0.286387  1
  H  H100  1  0.457299  0.167382  0.309044  1
  H  H101  1  0.623624  0.181082  0.286387  1
  H  H102  1  0.290632  0.667382  0.309044  1
  H  H103  1  0.456958  0.681082  0.286387  1
  H  H104  1  0.790632  0.167382  0.309044  1
  H  H105  1  0.956958  0.181082  0.286387  1
  H  H106  1  0.623966  0.667382  0.309044  1
  H  H107  1  0.790291  0.681082  0.286387  1
  H  H108  1  0.957299  0.667382  0.309044  1
  H  H109  1  0.091902  0.410299  0.320348  1
  H  H110  1  0.258703  0.424049  0.297727  1
  H  H111  1  0.092036  0.924049  0.297727  1
  H  H112  1  0.425235  0.410299  0.320348  1
  H  H113  1  0.592036  0.424049  0.297727  1
  H  H114  1  0.258568  0.910299  0.320348  1
  H  H115  1  0.425370  0.924049  0.297727  1
  H  H116  1  0.758568  0.410299  0.320348  1
  H  H117  1  0.925370  0.424049  0.297727  1
  H  H118  1  0.591902  0.910299  0.320348  1
  H  H119  1  0.758703  0.924049  0.297727  1
  H  H120  1  0.925235  0.910299  0.320348  1
  H  H121  1  0.091879  0.545628  0.303339  1
  H  H122  1  0.258462  0.532033  0.326001  1
  H  H123  1  0.091796  1.032033  0.326001  1
  H  H124  1  0.425212  0.545628  0.303339  1
  H  H125  1  0.591796  0.532033  0.326001  1
  H  H126  1  0.258546  1.045628  0.303339  1
  H  H127  1  0.425129  1.032033  0.326001  1
  H  H128  1  0.758546  0.545628  0.303339  1
  H  H129  1  0.925129  0.532033  0.326001  1
  H  H130  1  0.591879  1.045628  0.303339  1
  H  H131  1  0.758462  1.032033  0.326001  1
  H  H132  1  0.925212  1.045628  0.303339  1
  H  H133  1  0.123852  0.302422  0.292035  1
  H  H134  1  0.290701  0.288901  0.314711  1
  H  H135  1  0.124035  0.788901  0.314711  1
  H  H136  1  0.457186  0.302422  0.292035  1
  H  H137  1  0.624035  0.288901  0.314711  1
  H  H138  1  0.290519  0.802422  0.292035  1
  H  H139  1  0.457368  0.788901  0.314711  1
  H  H140  1  0.790519  0.302422  0.292035  1
  H  H141  1  0.957368  0.288901  0.314711  1
  H  H142  1  0.623852  0.802422  0.292035  1
  H  H143  1  0.790701  0.788901  0.314711  1
  H  H144  1  0.957186  0.802422  0.292035  1
  H  H145  1  0.124170  0.139862  0.354223  1
  H  H146  1  0.290748  0.153444  0.331599  1
  H  H147  1  0.124082  0.653444  0.331599  1
  H  H148  1  0.457503  0.139862  0.354223  1
  H  H149  1  0.624082  0.153444  0.331599  1
  H  H150  1  0.290837  0.639862  0.354223  1
  H  H151  1  0.457415  0.653444  0.331599  1
  H  H152  1  0.790837  0.139862  0.354223  1
  H  H153  1  0.957415  0.153444  0.331599  1
  H  H154  1  0.624170  0.639862  0.354223  1
  H  H155  1  0.790748  0.653444  0.331599  1
  H  H156  1  0.957503  0.639862  0.354223  1
  H  H157  1  0.091706  0.383013  0.365546  1
  H  H158  1  0.258450  0.396691  0.342968  1
  H  H159  1  0.091783  0.896691  0.342968  1
  H  H160  1  0.425039  0.383013  0.365546  1
  H  H161  1  0.591783  0.396691  0.342968  1
  H  H162  1  0.258373  0.883013  0.365546  1
  H  H163  1  0.425117  0.896691  0.342968  1
  H  H164  1  0.758373  0.383013  0.365546  1
  H  H165  1  0.925117  0.396691  0.342968  1
  H  H166  1  0.591706  0.883013  0.365546  1
  H  H167  1  0.758450  0.896691  0.342968  1
  H  H168  1  0.925039  0.883013  0.365546  1
  H  H169  1  0.091721  0.518334  0.348593  1
  H  H170  1  0.258352  0.504712  0.371203  1
  H  H171  1  0.091686  1.004712  0.371203  1
  H  H172  1  0.425055  0.518334  0.348593  1
  H  H173  1  0.591686  0.504712  0.371203  1
  H  H174  1  0.258388  1.018334  0.348593  1
  H  H175  1  0.425019  1.004712  0.371203  1
  H  H176  1  0.758388  0.518334  0.348593  1
  H  H177  1  0.925019  0.504712  0.371203  1
  H  H178  1  0.591721  1.018334  0.348593  1
  H  H179  1  0.758352  1.004712  0.371203  1
  H  H180  1  0.925055  1.018334  0.348593  1
  H  H181  1  0.124155  0.275233  0.337304  1
  H  H182  1  0.290889  0.261466  0.359883  1
  H  H183  1  0.124223  0.761466  0.359883  1
  H  H184  1  0.457488  0.275233  0.337304  1
  H  H185  1  0.624223  0.261466  0.359883  1
  H  H186  1  0.290821  0.775233  0.337304  1
  H  H187  1  0.457556  0.761466  0.359883  1
  H  H188  1  0.790821  0.275233  0.337304  1
  H  H189  1  0.957556  0.261466  0.359883  1
  H  H190  1  0.624155  0.775233  0.337304  1
  H  H191  1  0.790889  0.761466  0.359883  1
  H  H192  1  0.957488  0.775233  0.337304  1
  H  H193  1  0.124253  0.112533  0.399424  1
  H  H194  1  0.290884  0.126168  0.376820  1
  H  H195  1  0.124217  0.626168  0.376820  1
  H  H196  1  0.457586  0.112533  0.399424  1
  H  H197  1  0.624217  0.126168  0.376820  1
  H  H198  1  0.290919  0.612533  0.399424  1
  H  H199  1  0.457550  0.626168  0.376820  1
  H  H200  1  0.790919  0.112533  0.399424  1
  H  H201  1  0.957550  0.126168  0.376820  1
  H  H202  1  0.624253  0.612533  0.399424  1
  H  H203  1  0.790884  0.626168  0.376820  1
  H  H204  1  0.957586  0.612533  0.399424  1
  H  H205  1  0.091665  0.355677  0.410724  1
  H  H206  1  0.258346  0.369330  0.388129  1
  H  H207  1  0.091679  0.869330  0.388129  1
  H  H208  1  0.424998  0.355677  0.410724  1
  H  H209  1  0.591679  0.369330  0.388129  1
  H  H210  1  0.258332  0.855677  0.410724  1
  H  H211  1  0.425013  0.869330  0.388129  1
  H  H212  1  0.758332  0.355677  0.410724  1
  H  H213  1  0.925013  0.369330  0.388129  1
  H  H214  1  0.591665  0.855677  0.410724  1
  H  H215  1  0.758346  0.869330  0.388129  1
  H  H216  1  0.924998  0.855677  0.410724  1
  H  H217  1  0.091666  0.491029  0.393787  1
  H  H218  1  0.258332  0.477358  0.416381  1
  H  H219  1  0.091666  0.977358  0.416381  1
  H  H220  1  0.424999  0.491029  0.393787  1
  H  H221  1  0.591666  0.477358  0.416381  1
  H  H222  1  0.258333  0.991029  0.393787  1
  H  H223  1  0.424999  0.977358  0.416381  1
  H  H224  1  0.758333  0.491029  0.393787  1
  H  H225  1  0.924999  0.477358  0.416381  1
  H  H226  1  0.591666  0.991029  0.393787  1
  H  H227  1  0.758332  0.977358  0.416381  1
  H  H228  1  0.924999  0.991029  0.393787  1
  H  H229  1  0.124253  0.247856  0.382481  1
  H  H230  1  0.290934  0.234186  0.405077  1
  H  H231  1  0.124267  0.734186  0.405077  1
  H  H232  1  0.457586  0.247856  0.382481  1
  H  H233  1  0.624267  0.234186  0.405077  1
  H  H234  1  0.290920  0.747856  0.382481  1
  H  H235  1  0.457600  0.734186  0.405077  1
  H  H236  1  0.790920  0.247856  0.382481  1
  H  H237  1  0.957600  0.234186  0.405077  1
  H  H238  1  0.624253  0.747856  0.382481  1
  H  H239  1  0.790934  0.734186  0.405077  1
  H  H240  1  0.957586  0.747856  0.382481  1
  H  H241  1  0.124266  0.085183  0.444610  1
  H  H242  1  0.290933  0.098855  0.422017  1
  H  H243  1  0.124267  0.598855  0.422017  1
  H  H244  1  0.457600  0.085183  0.444610  1
  H  H245  1  0.624267  0.098855  0.422017  1
  H  H246  1  0.290933  0.585183  0.444610  1
  H  H247  1  0.457600  0.598855  0.422017  1
  H  H248  1  0.790933  0.085183  0.444610  1
  H  H249  1  0.957600  0.098855  0.422017  1
  H  H250  1  0.624266  0.585183  0.444610  1
  H  H251  1  0.790933  0.598855  0.422017  1
  H  H252  1  0.957600  0.585183  0.444610  1
  H  H253  1  0.091679  0.328357  0.455917  1
  H  H254  1  0.258332  0.342027  0.433321  1
  H  H255  1  0.091665  0.842027  0.433321  1
  H  H256  1  0.425013  0.328357  0.455917  1
  H  H257  1  0.591665  0.342027  0.433321  1
  H  H258  1  0.258346  0.828357  0.455917  1
  H  H259  1  0.424999  0.842027  0.433321  1
  H  H260  1  0.758346  0.328357  0.455917  1
  H  H261  1  0.924999  0.342027  0.433321  1
  H  H262  1  0.591679  0.828357  0.455917  1
  H  H263  1  0.758332  0.842027  0.433321  1
  H  H264  1  0.925013  0.828357  0.455917  1
  H  H265  1  0.091680  0.463680  0.438974  1
  H  H266  1  0.258382  0.450045  0.461578  1
  H  H267  1  0.091715  0.950045  0.461578  1
  H  H268  1  0.425013  0.463680  0.438974  1
  H  H269  1  0.591715  0.450045  0.461578  1
  H  H270  1  0.258346  0.963680  0.438974  1
  H  H271  1  0.425049  0.950045  0.461578  1
  H  H272  1  0.758346  0.463680  0.438974  1
  H  H273  1  0.925049  0.450045  0.461578  1
  H  H274  1  0.591680  0.963680  0.438974  1
  H  H275  1  0.758382  0.950045  0.461578  1
  H  H276  1  0.925013  0.963680  0.438974  1
  H  H277  1  0.124267  0.220535  0.427674  1
  H  H278  1  0.290919  0.206883  0.450268  1
  H  H279  1  0.124253  0.706883  0.450268  1
  H  H280  1  0.457601  0.220535  0.427674  1
  H  H281  1  0.624253  0.206883  0.450268  1
  H  H282  1  0.290934  0.720535  0.427674  1
  H  H283  1  0.457586  0.706883  0.450268  1
  H  H284  1  0.790934  0.220535  0.427674  1
  H  H285  1  0.957586  0.206883  0.450268  1
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  H  H348  1  0.957387  0.530584  0.535059  1
  H  H349  1  0.092080  0.273791  0.546363  1
  H  H350  1  0.258564  0.287312  0.523687  1
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  H  H357  1  0.925231  0.287312  0.523687  1
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  H  H361  1  0.091967  0.408831  0.529354  1
  H  H362  1  0.258975  0.395131  0.552011  1
  H  H363  1  0.092308  0.895131  0.552011  1
  H  H364  1  0.425300  0.408831  0.529354  1
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  H  H367  1  0.425641  0.895131  0.552011  1
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  H  H369  1  0.925641  0.395131  0.552011  1
  H  H370  1  0.591967  0.908831  0.529354  1
  H  H371  1  0.758975  0.895131  0.552011  1
  H  H372  1  0.925300  0.908831  0.529354  1
  H  H373  1  0.124031  0.165914  0.518050  1
  H  H374  1  0.290563  0.152164  0.540670  1
  H  H375  1  0.123896  0.652164  0.540670  1
  H  H376  1  0.457364  0.165914  0.518050  1
  H  H377  1  0.623896  0.152164  0.540670  1
  H  H378  1  0.290697  0.665914  0.518050  1
  H  H379  1  0.457229  0.652164  0.540670  1
  H  H380  1  0.790697  0.165914  0.518050  1
  H  H381  1  0.957229  0.152164  0.540670  1
  H  H382  1  0.624031  0.665914  0.518050  1
  H  H383  1  0.790563  0.652164  0.540670  1
  H  H384  1  0.957364  0.665914  0.518050  1
  H  H385  1  0.123441  1.002783  0.580058  1
  H  H386  1  0.290524  1.016426  0.557425  1
  H  H387  1  0.123857  0.516426  0.557425  1
  H  H388  1  0.456774  1.002783  0.580058  1
  H  H389  1  0.623857  1.016426  0.557425  1
  H  H390  1  0.290108  0.502783  0.580058  1
  H  H391  1  0.457190  0.516426  0.557425  1
  H  H392  1  0.790108  1.002783  0.580058  1
  H  H393  1  0.957190  1.016426  0.557425  1
  H  H394  1  0.623441  0.502783  0.580058  1
  H  H395  1  0.790524  0.516426  0.557425  1
  H  H396  1  0.956774  0.502783  0.580058  1
  H  H397  1  0.092894  0.247714  0.591514  1
  H  H398  1  0.259091  0.260168  0.568886  1
  H  H399  1  0.092424  0.760168  0.568886  1
  H  H400  1  0.426227  0.247714  0.591514  1
  H  H401  1  0.592424  0.260168  0.568886  1
  H  H402  1  0.259560  0.747714  0.591514  1
  H  H403  1  0.425757  0.760168  0.568886  1
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  H  H405  1  0.925757  0.260168  0.568886  1
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  H  H408  1  0.926227  0.747714  0.591514  1
  H  H409  1  0.092785  0.382003  0.574590  1
  H  H410  1  0.260037  0.368200  0.597335  1
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  H  H421  1  0.123632  0.138956  0.563232  1
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  H  H433  1  0.121085  0.976331  0.627231  1
  H  H434  1  0.289422  0.990328  0.602619  1
  H  H435  1  0.122755  0.490328  0.602619  1
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  H  H445  1  0.094953  0.216555  0.637411  1
  H  H446  1  0.260554  0.229581  0.613071  1
  H  H447  1  0.093887  0.729581  0.613071  1
  H  H448  1  0.428287  0.216555  0.637411  1
  H  H449  1  0.593887  0.229581  0.613071  1
  H  H450  1  0.261620  0.716555  0.637411  1
  H  H451  1  0.427221  0.729581  0.613071  1
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  H  H456  1  0.928287  0.716555  0.637411  1
  H  H457  1  0.093905  0.357188  0.620128  1
  H  H458  1  0.260155  0.329730  0.643061  1
  H  H459  1  0.093488  0.829730  0.643061  1
  H  H460  1  0.427239  0.357188  0.620128  1
  H  H461  1  0.593488  0.329730  0.643061  1
  H  H462  1  0.260572  0.857188  0.620128  1
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  H  H469  1  0.121562  0.110721  0.607943  1
  H  H470  1  0.286411  0.094560  0.632574  1
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  H  H479  1  0.786411  0.594560  0.632574  1
  H  H480  1  0.954895  0.610721  0.607943  1
