# generated using pymatgen
data_H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.99339021
_cell_length_b   23.55644602
_cell_length_c   45.82734718
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.86060426
_symmetry_Int_Tables_number   1
_chemical_formula_structural   H2
_chemical_formula_sum   H480
_cell_volume   9669.59787676
_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  0.742007  0.526913  0.292251  1
  H  H2  1  0.242007  0.526913  0.292251  1
  H  H3  1  0.785968  0.848044  0.321926  1
  H  H4  1  0.701337  0.186767  0.304399  1
  H  H5  1  0.285968  0.848044  0.321926  1
  H  H6  1  0.201337  0.186767  0.304399  1
  H  H7  1  0.722676  0.598046  0.326262  1
  H  H8  1  0.222676  0.598046  0.326262  1
  H  H9  1  0.763810  0.937821  0.305090  1
  H  H10  1  0.804087  0.275780  0.295442  1
  H  H11  1  0.263810  0.937821  0.305090  1
  H  H12  1  0.304087  0.275780  0.295442  1
  H  H13  1  0.576480  0.681835  0.305942  1
  H  H14  1  1.076480  0.681835  0.305942  1
  H  H15  1  0.741138  0.029605  0.288672  1
  H  H16  1  0.661727  0.347563  0.322055  1
  H  H17  1  0.241138  0.029605  0.288672  1
  H  H18  1  1.161727  0.347563  0.322055  1
  H  H19  1  0.679082  0.773710  0.295183  1
  H  H20  1  0.179082  0.773710  0.295183  1
  H  H21  1  0.598655  0.100176  0.315610  1
  H  H22  1  0.639400  0.436681  0.302618  1
  H  H23  1  1.098655  0.100176  0.315610  1
  H  H24  1  1.139400  0.436681  0.302618  1
  H  H25  1  0.492007  0.526913  0.292251  1
  H  H26  1  0.992007  0.526913  0.292251  1
  H  H27  1  0.535968  0.848044  0.321926  1
  H  H28  1  0.451337  0.186767  0.304399  1
  H  H29  1  1.035968  0.848044  0.321926  1
  H  H30  1  0.951337  0.186767  0.304399  1
  H  H31  1  0.472676  0.598046  0.326262  1
  H  H32  1  0.972676  0.598046  0.326262  1
  H  H33  1  0.513810  0.937821  0.305090  1
  H  H34  1  0.554087  0.275780  0.295442  1
  H  H35  1  1.013810  0.937821  0.305090  1
  H  H36  1  1.054087  0.275780  0.295442  1
  H  H37  1  0.326480  0.681835  0.305942  1
  H  H38  1  0.826480  0.681835  0.305942  1
  H  H39  1  0.491138  0.029605  0.288672  1
  H  H40  1  0.411727  0.347563  0.322055  1
  H  H41  1  0.991138  0.029605  0.288672  1
  H  H42  1  0.911727  0.347563  0.322055  1
  H  H43  1  0.429082  0.773710  0.295183  1
  H  H44  1  0.929082  0.773710  0.295183  1
  H  H45  1  0.348655  0.100176  0.315610  1
  H  H46  1  0.389400  0.436681  0.302618  1
  H  H47  1  0.848655  0.100176  0.315610  1
  H  H48  1  0.889400  0.436681  0.302618  1
  H  H49  1  0.621184  0.507866  0.336719  1
  H  H50  1  1.121184  0.507866  0.336719  1
  H  H51  1  0.665862  0.829049  0.366621  1
  H  H52  1  0.580270  0.169604  0.349463  1
  H  H53  1  1.165862  0.829049  0.366621  1
  H  H54  1  1.080270  0.169604  0.349463  1
  H  H55  1  0.603898  0.576681  0.371009  1
  H  H56  1  1.103898  0.576681  0.371009  1
  H  H57  1  0.643325  0.919659  0.350462  1
  H  H58  1  0.684005  0.256924  0.340330  1
  H  H59  1  1.143325  0.919659  0.350462  1
  H  H60  1  0.184005  0.256924  0.340330  1
  H  H61  1  0.580813  0.667727  0.355118  1
  H  H62  1  1.080813  0.667727  0.355118  1
  H  H63  1  0.621509  0.009266  0.333809  1
  H  H64  1  0.540796  0.330676  0.367051  1
  H  H65  1  1.121509  0.009266  0.333809  1
  H  H66  1  1.040796  0.330676  0.367051  1
  H  H67  1  0.558304  0.757406  0.339399  1
  H  H68  1  1.058304  0.757406  0.339399  1
  H  H69  1  0.478729  0.080936  0.360501  1
  H  H70  1  0.518568  0.419883  0.348317  1
  H  H71  1  0.978729  0.080936  0.360501  1
  H  H72  1  1.018568  0.419883  0.348317  1
  H  H73  1  0.371184  0.507866  0.336719  1
  H  H74  1  0.871184  0.507866  0.336719  1
  H  H75  1  0.415862  0.829049  0.366621  1
  H  H76  1  0.330270  0.169604  0.349463  1
  H  H77  1  0.915862  0.829049  0.366621  1
  H  H78  1  0.830270  0.169604  0.349463  1
  H  H79  1  0.353898  0.576681  0.371009  1
  H  H80  1  0.853898  0.576681  0.371009  1
  H  H81  1  0.393325  0.919659  0.350462  1
  H  H82  1  0.434005  0.256924  0.340330  1
  H  H83  1  0.893325  0.919659  0.350462  1
  H  H84  1  0.934005  0.256924  0.340330  1
  H  H85  1  0.330813  0.667727  0.355118  1
  H  H86  1  0.830813  0.667727  0.355118  1
  H  H87  1  0.371509  0.009266  0.333809  1
  H  H88  1  0.290796  0.330676  0.367051  1
  H  H89  1  0.871509  0.009266  0.333809  1
  H  H90  1  0.790796  0.330676  0.367051  1
  H  H91  1  0.308304  0.757406  0.339399  1
  H  H92  1  0.808304  0.757406  0.339399  1
  H  H93  1  0.228729  0.080936  0.360501  1
  H  H94  1  0.268568  0.419883  0.348317  1
  H  H95  1  0.728729  0.080936  0.360501  1
  H  H96  1  0.768568  0.419883  0.348317  1
  H  H97  1  0.500822  0.489617  0.380919  1
  H  H98  1  1.000822  0.489617  0.380919  1
  H  H99  1  0.546128  0.808195  0.410962  1
  H  H100  1  0.459072  0.150883  0.393433  1
  H  H101  1  1.046128  0.808195  0.410962  1
  H  H102  1  0.959072  0.150883  0.393433  1
  H  H103  1  0.482626  0.557947  0.415166  1
  H  H104  1  0.982626  0.557947  0.415166  1
  H  H105  1  0.523520  0.899581  0.394834  1
  H  H106  1  0.563205  0.239118  0.384132  1
  H  H107  1  1.023520  0.899581  0.394834  1
  H  H108  1  1.063205  0.239118  0.384132  1
  H  H109  1  0.460846  0.647612  0.399051  1
  H  H110  1  0.960846  0.647612  0.399051  1
  H  H111  1  0.501060  -0.008825  0.378778  1
  H  H112  1  0.420428  0.310894  0.411433  1
  H  H113  1  1.001060  -0.008825  0.378778  1
  H  H114  1  0.920428  0.310894  0.411433  1
  H  H115  1  0.438276  0.738237  0.383198  1
  H  H116  1  0.938276  0.738237  0.383198  1
  H  H117  1  0.357606  0.063184  0.407313  1
  H  H118  1  0.397275  0.403216  0.395160  1
  H  H119  1  0.857606  0.063184  0.407313  1
  H  H120  1  0.897275  0.403216  0.395160  1
  H  H121  1  0.250822  0.489617  0.380919  1
  H  H122  1  0.750822  0.489617  0.380919  1
  H  H123  1  0.296128  0.808195  0.410962  1
  H  H124  1  0.209072  0.150883  0.393433  1
  H  H125  1  0.796128  0.808195  0.410962  1
  H  H126  1  0.709072  0.150883  0.393433  1
  H  H127  1  0.232626  0.557947  0.415166  1
  H  H128  1  0.732626  0.557947  0.415166  1
  H  H129  1  0.273520  0.899581  0.394834  1
  H  H130  1  0.313205  0.239118  0.384132  1
  H  H131  1  0.773520  0.899581  0.394834  1
  H  H132  1  0.813205  0.239118  0.384132  1
  H  H133  1  0.210846  0.647612  0.399051  1
  H  H134  1  0.710846  0.647612  0.399051  1
  H  H135  1  0.251060  -0.008825  0.378778  1
  H  H136  1  0.170428  0.310894  0.411433  1
  H  H137  1  0.751060  -0.008825  0.378778  1
  H  H138  1  0.670428  0.310894  0.411433  1
  H  H139  1  0.188276  0.738237  0.383198  1
  H  H140  1  0.688276  0.738237  0.383198  1
  H  H141  1  1.107606  0.063184  0.407313  1
  H  H142  1  1.147275  0.403216  0.395160  1
  H  H143  1  0.607606  0.063184  0.407313  1
  H  H144  1  0.647275  0.403216  0.395160  1
  H  H145  1  0.506033  0.467049  0.428531  1
  H  H146  1  1.006033  0.467049  0.428531  1
  H  H147  1  0.426972  0.785520  0.455196  1
  H  H148  1  0.467627  0.127427  0.440678  1
  H  H149  1  0.926972  0.785520  0.455196  1
  H  H150  1  0.967627  0.127427  0.440678  1
  H  H151  1  0.364018  0.534315  0.458580  1
  H  H152  1  0.864018  0.534315  0.458580  1
  H  H153  1  0.404221  0.877351  0.439130  1
  H  H154  1  0.443324  0.219683  0.427746  1
  H  H155  1  0.904221  0.877351  0.439130  1
  H  H156  1  0.943324  0.219683  0.427746  1
  H  H157  1  0.341185  0.625959  0.443314  1
  H  H158  1  0.841185  0.625959  0.443314  1
  H  H159  1  0.381286  -0.030464  0.423204  1
  H  H160  1  0.302105  0.286644  0.456315  1
  H  H161  1  0.881286  -0.030464  0.423204  1
  H  H162  1  0.802105  0.286644  0.456315  1
  H  H163  1  0.318674  0.716864  0.427213  1
  H  H164  1  0.818674  0.716864  0.427213  1
  H  H165  1  0.239808  0.036125  0.452942  1
  H  H166  1  0.278769  0.376881  0.441224  1
  H  H167  1  0.739808  0.036125  0.452942  1
  H  H168  1  0.778769  0.376881  0.441224  1
  H  H169  1  0.256033  0.467049  0.428531  1
  H  H170  1  0.756033  0.467049  0.428531  1
  H  H171  1  0.176972  0.785520  0.455196  1
  H  H172  1  0.217627  0.127427  0.440678  1
  H  H173  1  0.676972  0.785520  0.455196  1
  H  H174  1  0.717627  0.127427  0.440678  1
  H  H175  1  1.114018  0.534315  0.458580  1
  H  H176  1  0.614018  0.534315  0.458580  1
  H  H177  1  1.154221  0.877351  0.439130  1
  H  H178  1  0.193324  0.219683  0.427746  1
  H  H179  1  0.654221  0.877351  0.439130  1
  H  H180  1  0.693324  0.219683  0.427746  1
  H  H181  1  1.091185  0.625959  0.443314  1
  H  H182  1  0.591185  0.625959  0.443314  1
  H  H183  1  1.131286  -0.030464  0.423204  1
  H  H184  1  1.052105  0.286644  0.456315  1
  H  H185  1  0.631286  -0.030464  0.423204  1
  H  H186  1  0.552105  0.286644  0.456315  1
  H  H187  1  1.068674  0.716864  0.427213  1
  H  H188  1  0.568674  0.716864  0.427213  1
  H  H189  1  0.989808  0.036125  0.452942  1
  H  H190  1  1.028769  0.376881  0.441224  1
  H  H191  1  0.489808  0.036125  0.452942  1
  H  H192  1  0.528769  0.376881  0.441224  1
  H  H193  1  0.386770  0.443203  0.472587  1
  H  H194  1  0.886770  0.443203  0.472587  1
  H  H195  1  0.308179  0.761578  0.499416  1
  H  H196  1  0.348086  0.102637  0.484366  1
  H  H197  1  0.808179  0.761578  0.499416  1
  H  H198  1  0.848086  0.102637  0.484366  1
  H  H199  1  0.245009  0.510457  0.502475  1
  H  H200  1  0.745009  0.510457  0.502475  1
  H  H201  1  0.285560  0.853323  0.483514  1
  H  H202  1  0.324931  0.194499  0.470909  1
  H  H203  1  0.785560  0.853323  0.483514  1
  H  H204  1  0.824931  0.194499  0.470909  1
  H  H205  1  0.222275  0.602072  0.487172  1
  H  H206  1  0.722275  0.602072  0.487172  1
  H  H207  1  0.262861  0.944916  0.467930  1
  H  H208  1  0.182976  0.261617  0.500309  1
  H  H209  1  0.762861  0.944916  0.467930  1
  H  H210  1  0.682976  0.261617  0.500309  1
  H  H211  1  0.199643  0.693887  0.471366  1
  H  H212  1  0.699643  0.693887  0.471366  1
  H  H213  1  1.121029  0.011779  0.497786  1
  H  H214  1  1.160203  0.352878  0.486265  1
  H  H215  1  0.621029  0.011779  0.497786  1
  H  H216  1  0.660203  0.352878  0.486265  1
  H  H217  1  1.136770  0.443203  0.472587  1
  H  H218  1  0.636770  0.443203  0.472587  1
  H  H219  1  1.058179  0.761578  0.499416  1
  H  H220  1  1.098086  0.102637  0.484366  1
  H  H221  1  0.558179  0.761578  0.499416  1
  H  H222  1  0.598086  0.102637  0.484366  1
  H  H223  1  0.995009  0.510457  0.502475  1
  H  H224  1  0.495009  0.510457  0.502475  1
  H  H225  1  1.035560  0.853323  0.483514  1
  H  H226  1  1.074931  0.194499  0.470909  1
  H  H227  1  0.535560  0.853323  0.483514  1
  H  H228  1  0.574931  0.194499  0.470909  1
  H  H229  1  0.972275  0.602072  0.487172  1
  H  H230  1  0.472275  0.602072  0.487172  1
  H  H231  1  1.012861  0.944916  0.467930  1
  H  H232  1  0.932976  0.261617  0.500309  1
  H  H233  1  0.512861  0.944916  0.467930  1
  H  H234  1  0.432976  0.261617  0.500309  1
  H  H235  1  0.949643  0.693887  0.471366  1
  H  H236  1  0.449643  0.693887  0.471366  1
  H  H237  1  0.871029  0.011779  0.497786  1
  H  H238  1  0.910203  0.352878  0.486265  1
  H  H239  1  0.371029  0.011779  0.497786  1
  H  H240  1  0.410203  0.352878  0.486265  1
  H  H241  1  0.268029  0.419495  0.517051  1
  H  H242  1  0.768029  0.419495  0.517051  1
  H  H243  1  0.189415  0.737388  0.543471  1
  H  H244  1  0.228855  0.078396  0.528572  1
  H  H245  1  0.689415  0.737388  0.543471  1
  H  H246  1  0.728855  0.078396  0.528572  1
  H  H247  1  1.126197  0.486359  0.546907  1
  H  H248  1  0.626197  0.486359  0.546907  1
  H  H249  1  0.166783  0.829203  0.527665  1
  H  H250  1  0.206082  0.169657  0.514529  1
  H  H251  1  0.666783  0.829203  0.527665  1
  H  H252  1  0.706082  0.169657  0.514529  1
  H  H253  1  1.103498  0.577952  0.531324  1
  H  H254  1  0.603498  0.577952  0.531324  1
  H  H255  1  1.144049  0.920817  0.512362  1
  H  H256  1  1.064127  0.236776  0.543929  1
  H  H257  1  0.644049  0.920817  0.512362  1
  H  H258  1  0.564127  0.236776  0.543929  1
  H  H259  1  1.080879  0.669697  0.515421  1
  H  H260  1  0.580879  0.669697  0.515421  1
  H  H261  1  1.002288  -0.011928  0.542250  1
  H  H262  1  1.040972  0.328637  0.530471  1
  H  H263  1  0.502288  -0.011928  0.542250  1
  H  H264  1  0.540972  0.328637  0.530471  1
  H  H265  1  1.018029  0.419495  0.517051  1
  H  H266  1  0.518029  0.419495  0.517051  1
  H  H267  1  0.939415  0.737388  0.543471  1
  H  H268  1  0.978855  0.078396  0.528572  1
  H  H269  1  0.439415  0.737388  0.543471  1
  H  H270  1  0.478855  0.078396  0.528572  1
  H  H271  1  0.876197  0.486359  0.546907  1
  H  H272  1  0.376197  0.486359  0.546907  1
  H  H273  1  0.916783  0.829203  0.527665  1
  H  H274  1  0.956082  0.169657  0.514529  1
  H  H275  1  0.416783  0.829203  0.527665  1
  H  H276  1  0.456082  0.169657  0.514529  1
  H  H277  1  0.853498  0.577952  0.531324  1
  H  H278  1  0.353498  0.577952  0.531324  1
  H  H279  1  0.894049  0.920817  0.512362  1
  H  H280  1  0.814127  0.236776  0.543929  1
  H  H281  1  0.394049  0.920817  0.512362  1
  H  H282  1  0.314127  0.236776  0.543929  1
  H  H283  1  0.830879  0.669697  0.515421  1
  H  H284  1  0.330879  0.669697  0.515421  1
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  H  H379  1  0.592930  0.623079  0.603875  1
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  H  H385  1  0.910329  0.350338  0.654336  1
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  H  H393  1  0.808245  0.763547  0.659719  1
  H  H394  1  0.848262  0.100598  0.647787  1
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  H  H397  1  0.745733  0.511615  0.664375  1
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  H  H452  1  1.103090  0.583230  0.692911  1
  H  H453  1  0.647051  0.904361  0.722586  1
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  H  H457  1  0.540403  0.331099  0.699227  1
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  H  H477  1  0.397051  0.904361  0.722586  1
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  H  H479  1  0.897051  0.904361  0.722586  1
  H  H480  1  0.937721  0.244508  0.710438  1
