# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   21.41809871
_cell_length_b   22.15782667
_cell_length_c   16.61258407
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C479
_cell_volume   7883.97554288
_cell_formula_units_Z   479
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
  C  C1  1  0.109605  0.417814  0.860762  1
  C  C2  1  0.110162  0.912763  0.859018  1
  C  C3  1  0.609625  0.417794  0.860738  1
  C  C4  1  0.610034  0.911669  0.857866  1
  C  C5  1  0.075493  0.082035  0.511531  1
  C  C6  1  0.075697  0.581852  0.512411  1
  C  C7  1  0.575488  0.082042  0.511571  1
  C  C8  1  0.575697  0.581852  0.512411  1
  C  C9  1  0.325608  0.395554  0.808146  1
  C  C10  1  0.326167  0.888644  0.805243  1
  C  C11  1  0.825634  0.395566  0.808144  1
  C  C12  1  0.826116  0.889507  0.805675  1
  C  C13  1  0.080327  0.399091  0.033327  1
  C  C14  1  0.079987  0.892309  0.030650  1
  C  C15  1  0.580336  0.399066  0.033298  1
  C  C16  1  0.580441  0.892369  0.030207  1
  C  C17  1  0.186221  0.639455  0.842399  1
  C  C18  1  0.686687  0.133325  0.840766  1
  C  C19  1  0.686208  0.639446  0.842386  1
  C  C20  1  0.386796  0.417794  0.860747  1
  C  C21  1  0.387435  0.910613  0.857911  1
  C  C22  1  0.886815  0.417815  0.860753  1
  C  C23  1  0.887242  0.911624  0.858546  1
  C  C24  1  0.415362  0.079438  0.918432  1
  C  C25  1  0.416095  0.586344  0.922658  1
  C  C26  1  0.916474  0.079991  0.921427  1
  C  C27  1  0.916084  0.586369  0.922669  1
  C  C28  1  0.170786  0.334486  0.944913  1
  C  C29  1  0.170706  0.828182  0.941957  1
  C  C30  1  0.670813  0.334474  0.944893  1
  C  C31  1  0.671074  0.828054  0.941719  1
  C  C32  1  0.286609  0.133456  0.091964  1
  C  C33  1  0.286552  0.640300  0.095254  1
  C  C34  1  0.786577  0.133449  0.093856  1
  C  C35  1  0.786521  0.640304  0.095253  1
  C  C36  1  0.386696  0.060771  0.091806  1
  C  C37  1  0.386815  0.567622  0.095221  1
  C  C38  1  0.886860  0.060808  0.093821  1
  C  C39  1  0.886795  0.567640  0.095230  1
  C  C40  1  0.420666  0.082045  0.511569  1
  C  C41  1  0.420875  0.581853  0.512411  1
  C  C42  1  0.920671  0.082034  0.511535  1
  C  C43  1  0.920875  0.581853  0.512411  1
  C  C44  1  0.165960  0.145734  0.421965  1
  C  C45  1  0.166165  0.645486  0.422764  1
  C  C46  1  0.665958  0.145736  0.422004  1
  C  C47  1  0.666165  0.645485  0.422765  1
  C  C48  1  0.420673  0.397820  0.439691  1
  C  C49  1  0.420875  0.897578  0.440144  1
  C  C50  1  0.920666  0.397813  0.439678  1
  C  C51  1  0.920875  0.897578  0.440143  1
  C  C52  1  0.110603  0.061713  0.089292  1
  C  C53  1  0.109625  0.567642  0.095237  1
  C  C54  1  0.609640  0.060778  0.092940  1
  C  C55  1  0.609606  0.567620  0.095216  1
  C  C56  1  0.310212  0.473184  0.214656  1
  C  C57  1  0.310347  0.966550  0.211692  1
  C  C58  1  0.810200  0.473190  0.214655  1
  C  C59  1  0.810036  0.966022  0.212538  1
  C  C60  1  0.998079  0.110887  0.289635  1
  C  C61  1  -0.001714  0.610542  0.290475  1
  C  C62  1  0.498079  0.110886  0.289670  1
  C  C63  1  0.498286  0.610542  0.290476  1
  C  C64  1  0.459601  0.415298  0.521358  1
  C  C65  1  0.459804  0.915113  0.521788  1
  C  C66  1  0.959596  0.415290  0.521344  1
  C  C67  1  0.959804  0.915113  0.521788  1
  C  C68  1  0.123710  0.388628  0.114174  1
  C  C69  1  0.123638  0.882250  0.111343  1
  C  C70  1  0.623717  0.388608  0.114148  1
  C  C71  1  0.623702  0.881710  0.111118  1
  C  C72  1  0.136677  0.127295  0.509673  1
  C  C73  1  0.136881  0.627110  0.510495  1
  C  C74  1  0.636673  0.127301  0.509712  1
  C  C75  1  0.636881  0.627110  0.510496  1
  C  C76  1  0.036442  0.457711  0.056419  1
  C  C77  1  0.036457  0.951343  0.053428  1
  C  C78  1  0.536441  0.457679  0.056389  1
  C  C79  1  0.536508  0.950928  0.053427  1
  C  C80  1  0.186208  0.345990  0.113594  1
  C  C81  1  0.186086  0.839566  0.110667  1
  C  C82  1  0.686222  0.345979  0.113575  1
  C  C83  1  0.686214  0.839091  0.110499  1
  C  C84  1  0.122578  0.282026  0.661799  1
  C  C85  1  0.122783  0.781948  0.662419  1
  C  C86  1  0.622577  0.282032  0.661827  1
  C  C87  1  0.622783  0.781948  0.662419  1
  C  C88  1  0.261780  0.115911  0.765242  1
  C  C89  1  0.248213  0.619862  0.789718  1
  C  C90  1  0.748789  0.113869  0.788200  1
  C  C91  1  0.748206  0.619863  0.789711  1
  C  C92  1  0.075487  0.335356  0.304030  1
  C  C93  1  0.075697  0.835022  0.304578  1
  C  C94  1  0.575493  0.335354  0.304050  1
  C  C95  1  0.575697  0.835021  0.304579  1
  C  C96  1  0.310199  0.345981  0.113587  1
  C  C97  1  0.310094  0.839343  0.110712  1
  C  C98  1  0.810213  0.345988  0.113582  1
  C  C99  1  0.810208  0.839113  0.110835  1
  C  C100  1  0.209847  0.204115  0.397827  1
  C  C101  1  0.210055  0.703846  0.398545  1
  C  C102  1  0.709849  0.204111  0.397853  1
  C  C103  1  0.710055  0.703846  0.398546  1
  C  C104  1  0.122577  0.345396  0.609891  1
  C  C105  1  0.122783  0.845281  0.610428  1
  C  C106  1  0.622578  0.345400  0.609914  1
  C  C107  1  0.622783  0.845280  0.610428  1
  C  C108  1  0.060075  0.388019  0.608548  1
  C  C109  1  0.060282  0.887903  0.609028  1
  C  C110  1  0.560078  0.388025  0.608566  1
  C  C111  1  0.560282  0.887903  0.609029  1
  C  C112  1  0.330199  0.145741  0.422000  1
  C  C113  1  0.330407  0.645486  0.422765  1
  C  C114  1  0.830201  0.145730  0.421974  1
  C  C115  1  0.830407  0.645485  0.422764  1
  C  C116  1  0.075488  0.397815  0.439675  1
  C  C117  1  0.075697  0.897578  0.440143  1
  C  C118  1  0.575494  0.397817  0.439693  1
  C  C119  1  0.575697  0.897578  0.440144  1
  C  C120  1  0.036408  0.093541  0.595511  1
  C  C121  1  0.036612  0.593417  0.596376  1
  C  C122  1  0.536403  0.093549  0.595551  1
  C  C123  1  0.536612  0.593417  0.596377  1
  C  C124  1  0.248213  0.429132  0.216768  1
  C  C125  1  0.248224  0.922699  0.213690  1
  C  C126  1  0.748208  0.429128  0.216759  1
  C  C127  1  0.748033  0.921964  0.214244  1
  C  C128  1  0.459595  0.064564  0.429904  1
  C  C129  1  0.459804  0.564317  0.430767  1
  C  C130  1  0.959599  0.064559  0.429868  1
  C  C131  1  0.959804  0.564317  0.430766  1
  C  C132  1  0.080080  0.083653  0.917908  1
  C  C133  1  0.080336  0.586369  0.922677  1
  C  C134  1  0.580555  0.080097  0.920436  1
  C  C135  1  0.580327  0.586344  0.922652  1
  C  C136  1  0.122577  0.134457  0.341313  1
  C  C137  1  0.122783  0.634150  0.342126  1
  C  C138  1  0.622576  0.134456  0.341352  1
  C  C139  1  0.622783  0.634150  0.342127  1
  C  C140  1  0.212345  0.174781  0.939444  1
  C  C141  1  0.209740  0.667607  0.929105  1
  C  C142  1  0.710059  0.161237  0.927669  1
  C  C143  1  0.709716  0.667601  0.929095  1
  C  C144  1  0.323955  0.142424  0.006330  1
  C  C145  1  0.325635  0.650950  0.011072  1
  C  C146  1  0.825828  0.144316  0.009870  1
  C  C147  1  0.825608  0.650960  0.011075  1
  C  C148  1  0.386796  0.379744  0.945942  1
  C  C149  1  0.387046  0.872594  0.943207  1
  C  C150  1  0.886815  0.379765  0.945948  1
  C  C151  1  0.887073  0.873319  0.943570  1
  C  C152  1  0.075491  0.144500  0.647170  1
  C  C153  1  0.075697  0.644409  0.647976  1
  C  C154  1  0.575488  0.144504  0.647214  1
  C  C155  1  0.575697  0.644409  0.647977  1
  C  C156  1  0.136676  0.166209  0.594171  1
  C  C157  1  0.136881  0.666081  0.594947  1
  C  C158  1  0.636673  0.166211  0.594212  1
  C  C159  1  0.636881  0.666081  0.594948  1
  C  C160  1  0.460262  0.021044  0.896458  1
  C  C161  1  0.459980  0.527725  0.899563  1
  C  C162  1  0.960660  0.021448  0.897990  1
  C  C163  1  0.959979  0.527756  0.899581  1
  C  C164  1  0.359483  0.166216  0.594208  1
  C  C165  1  0.359691  0.666081  0.594947  1
  C  C166  1  0.859487  0.166203  0.594182  1
  C  C167  1  0.859691  0.666081  0.594947  1
  C  C168  1  0.251402  0.050930  0.729513  1
  C  C169  1  0.248207  0.556304  0.739218  1
  C  C170  1  0.748859  0.050451  0.737378  1
  C  C171  1  0.748213  0.556306  0.739210  1
  C  C172  1  0.136673  0.352557  0.441531  1
  C  C173  1  0.136881  0.852320  0.442058  1
  C  C174  1  0.636677  0.352556  0.441553  1
  C  C175  1  0.636881  0.852320  0.442059  1
  C  C176  1  0.171417  0.083726  0.144402  1
  C  C177  1  0.170813  0.589882  0.147838  1
  C  C178  1  0.670735  0.082872  0.145833  1
  C  C179  1  0.670787  0.589869  0.147825  1
  C  C180  1  0.209851  0.275744  0.553383  1
  C  C181  1  0.210055  0.775585  0.554009  1
  C  C182  1  0.709848  0.275741  0.553406  1
  C  C183  1  0.710055  0.775584  0.554009  1
  C  C184  1  0.186221  0.473194  0.214663  1
  C  C185  1  0.186362  0.966965  0.211295  1
  C  C186  1  0.686209  0.473181  0.214648  1
  C  C187  1  0.686036  0.966020  0.212155  1
  C  C188  1  0.286313  0.275748  0.553399  1
  C  C189  1  0.286517  0.775585  0.554009  1
  C  C190  1  0.786310  0.275737  0.553392  1
  C  C191  1  0.786517  0.775585  0.554009  1
  C  C192  1  0.459758  0.386312  0.355712  1
  C  C193  1  0.459960  0.886013  0.356178  1
  C  C194  1  0.959750  0.386309  0.355697  1
  C  C195  1  0.959960  0.886013  0.356178  1
  C  C196  1  0.110466  0.101003  0.006758  1
  C  C197  1  0.109625  0.605692  0.010042  1
  C  C198  1  0.609761  0.099108  0.007969  1
  C  C199  1  0.609606  0.605671  0.010021  1
  C  C200  1  0.330203  0.334127  0.529258  1
  C  C201  1  0.330407  0.833945  0.529791  1
  C  C202  1  0.830199  0.334115  0.529245  1
  C  C203  1  0.830407  0.833945  0.529790  1
  C  C204  1  0.416074  -0.005970  0.110839  1
  C  C205  1  0.416095  0.500818  0.114155  1
  C  C206  1  0.916110  -0.006039  0.112538  1
  C  C207  1  0.916085  0.500840  0.114168  1
  C  C208  1  0.373584  0.197828  0.289436  1
  C  C209  1  0.373789  0.697482  0.290135  1
  C  C210  1  0.873581  0.197826  0.289413  1
  C  C211  1  0.873789  0.697482  0.290135  1
  C  C212  1  0.436083  0.261862  0.711922  1
  C  C213  1  0.436290  0.761809  0.712543  1
  C  C214  1  0.936087  0.261847  0.711901  1
  C  C215  1  0.936291  0.761809  0.712542  1
  C  C216  1  0.326137  0.083144  0.145042  1
  C  C217  1  0.325634  0.589871  0.147830  1
  C  C218  1  0.825577  0.082891  0.146330  1
  C  C219  1  0.825608  0.589880  0.147832  1
  C  C220  1  0.060075  0.091834  0.342659  1
  C  C221  1  0.060282  0.591527  0.343525  1
  C  C222  1  0.560074  0.091833  0.342698  1
  C  C223  1  0.560281  0.591527  0.343526  1
  C  C224  1  0.165957  0.246660  0.339299  1
  C  C225  1  0.166165  0.746349  0.339963  1
  C  C226  1  0.665959  0.246656  0.339325  1
  C  C227  1  0.666165  0.746349  0.339964  1
  C  C228  1  0.122575  0.197829  0.289407  1
  C  C229  1  0.122783  0.697482  0.290135  1
  C  C230  1  0.622577  0.197824  0.289438  1
  C  C231  1  0.622783  0.697482  0.290136  1
  C  C232  1  0.385375  0.098423  0.006010  1
  C  C233  1  0.386816  0.605672  0.010026  1
  C  C234  1  0.887034  0.099033  0.008736  1
  C  C235  1  0.886795  0.605690  0.010035  1
  C  C236  1  0.116956  0.091560  0.836883  1
  C  C237  1  0.123717  0.596826  0.841826  1
  C  C238  1  0.624149  0.090744  0.839820  1
  C  C239  1  0.623710  0.596808  0.841806  1
  C  C240  1  0.209716  0.441679  0.749593  1
  C  C241  1  0.210275  0.937584  0.748351  1
  C  C242  1  0.709739  0.441675  0.749580  1
  C  C243  1  0.710319  0.935819  0.747065  1
  C  C244  1  0.123716  0.452518  0.164937  1
  C  C245  1  0.123979  0.946709  0.160879  1
  C  C246  1  0.623711  0.452496  0.164914  1
  C  C247  1  0.623619  0.945483  0.162142  1
  C  C248  1  0.036560  0.415291  0.521342  1
  C  C249  1  0.036768  0.915113  0.521787  1
  C  C250  1  0.536565  0.415296  0.521359  1
  C  C251  1  0.536768  0.915113  0.521788  1
  C  C252  1  0.459979  0.457680  0.056395  1
  C  C253  1  0.460047  0.950802  0.053327  1
  C  C254  1  0.959980  0.457710  0.056413  1
  C  C255  1  0.959977  0.951072  0.054451  1
  C  C256  1  0.170786  0.395564  0.808154  1
  C  C257  1  0.171409  0.890651  0.806264  1
  C  C258  1  0.670812  0.395554  0.808136  1
  C  C259  1  0.671291  0.889553  0.805301  1
  C  C260  1  0.313242  0.003933  0.735045  1
  C  C261  1  0.310199  0.512242  0.741322  1
  C  C262  1  0.810836  0.006382  0.739438  1
  C  C263  1  0.810212  0.512253  0.741320  1
  C  C264  1  0.060078  0.261849  0.711898  1
  C  C265  1  0.060282  0.761809  0.712542  1
  C  C266  1  0.560075  0.261860  0.711924  1
  C  C267  1  0.560282  0.761809  0.712543  1
  C  C268  1  0.373584  0.345406  0.609911  1
  C  C269  1  0.373789  0.845281  0.610429  1
  C  C270  1  0.873583  0.345393  0.609896  1
  C  C271  1  0.873789  0.845281  0.610428  1
  C  C272  1  0.170663  0.148781  0.009268  1
  C  C273  1  0.170812  0.650962  0.011080  1
  C  C274  1  0.670964  0.144354  0.009423  1
  C  C275  1  0.670786  0.650950  0.011067  1
  C  C276  1  0.287022  0.037238  0.203507  1
  C  C277  1  0.286704  0.543756  0.206391  1
  C  C278  1  0.786532  0.036612  0.204537  1
  C  C279  1  0.786681  0.543759  0.206389  1
  C  C280  1  0.286309  0.204117  0.397847  1
  C  C281  1  0.286517  0.703846  0.398545  1
  C  C282  1  0.786311  0.204110  0.397837  1
  C  C283  1  0.786517  0.703846  0.398545  1
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