# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   21.40228446
_cell_length_b   21.94011546
_cell_length_c   16.43261153
_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   7716.2382595
_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  0.110483  0.420390  0.861662  1
  C  C2  1  0.109671  0.920543  0.861207  1
  C  C3  1  0.612375  0.422880  0.857537  1
  C  C4  1  0.609667  0.920539  0.861229  1
  C  C5  1  0.075817  0.084516  0.518508  1
  C  C6  1  0.075738  0.585807  0.520214  1
  C  C7  1  0.575955  0.084577  0.518426  1
  C  C8  1  0.575752  0.585728  0.519930  1
  C  C9  1  0.325746  0.898768  0.807520  1
  C  C10  1  0.828416  0.400956  0.806202  1
  C  C11  1  0.825740  0.898758  0.807562  1
  C  C12  1  0.080765  0.399734  0.036881  1
  C  C13  1  0.080420  0.899469  0.035201  1
  C  C14  1  0.581362  0.399766  0.030627  1
  C  C15  1  0.580420  0.899488  0.035234  1
  C  C16  1  0.186302  0.144710  0.847680  1
  C  C17  1  0.186391  0.644548  0.849098  1
  C  C18  1  0.686304  0.144705  0.847649  1
  C  C19  1  0.689684  0.647503  0.849476  1
  C  C20  1  0.411272  0.417243  0.869915  1
  C  C21  1  0.386977  0.920547  0.861199  1
  C  C22  1  0.889205  0.421898  0.861296  1
  C  C23  1  0.886974  0.920541  0.861234  1
  C  C24  1  0.416226  0.090068  0.927658  1
  C  C25  1  0.417072  0.588274  0.927043  1
  C  C26  1  0.916229  0.090071  0.927638  1
  C  C27  1  0.918035  0.590902  0.931995  1
  C  C28  1  0.169032  0.334308  0.945710  1
  C  C29  1  0.170882  0.835292  0.944377  1
  C  C30  1  0.672476  0.336465  0.939854  1
  C  C31  1  0.670879  0.835304  0.944428  1
  C  C32  1  0.286676  0.142402  0.103344  1
  C  C33  1  0.288734  0.641212  0.103853  1
  C  C34  1  0.786679  0.142429  0.103310  1
  C  C35  1  0.787551  0.641909  0.106880  1
  C  C36  1  0.386975  0.068992  0.101651  1
  C  C37  1  0.388481  0.567172  0.101137  1
  C  C38  1  0.886978  0.069013  0.101633  1
  C  C39  1  0.887601  0.568238  0.105270  1
  C  C40  1  0.421067  0.084528  0.518492  1
  C  C41  1  0.420870  0.585732  0.519961  1
  C  C42  1  0.920927  0.084571  0.518454  1
  C  C43  1  0.920850  0.585825  0.520229  1
  C  C44  1  0.166322  0.148633  0.427685  1
  C  C45  1  0.166199  0.649555  0.428849  1
  C  C46  1  0.666366  0.148779  0.427550  1
  C  C47  1  0.666208  0.649502  0.428595  1
  C  C48  1  0.420946  0.403469  0.444290  1
  C  C49  1  0.420849  0.904351  0.443402  1
  C  C50  1  0.921058  0.403499  0.444143  1
  C  C51  1  0.920890  0.904424  0.443486  1
  C  C52  1  0.109672  0.068985  0.101651  1
  C  C53  1  0.111181  0.568890  0.103975  1
  C  C54  1  0.609671  0.069016  0.101636  1
  C  C55  1  0.610489  0.568669  0.100639  1
  C  C56  1  0.311858  0.470530  0.220189  1
  C  C57  1  0.310347  0.972051  0.220260  1
  C  C58  1  0.809683  0.470068  0.220633  1
  C  C59  1  0.810347  0.972099  0.220275  1
  C  C60  1  0.998428  0.113144  0.293949  1
  C  C61  1  0.998289  0.613456  0.295474  1
  C  C62  1  0.498446  0.113194  0.293934  1
  C  C63  1  0.498294  0.613438  0.295216  1
  C  C64  1  0.459896  0.421307  0.526785  1
  C  C65  1  0.459785  0.922525  0.525778  1
  C  C66  1  0.959983  0.421325  0.526664  1
  C  C67  1  0.959830  0.922608  0.525855  1
  C  C68  1  0.124228  0.387762  0.118216  1
  C  C69  1  0.123790  0.887905  0.116730  1
  C  C70  1  0.624041  0.387346  0.112591  1
  C  C71  1  0.623786  0.887942  0.116772  1
  C  C72  1  0.137054  0.130208  0.516447  1
  C  C73  1  0.136961  0.631506  0.517765  1
  C  C74  1  0.637155  0.130315  0.516329  1
  C  C75  1  0.636969  0.631436  0.517504  1
  C  C76  1  0.037221  0.458610  0.062386  1
  C  C77  1  0.036584  0.958442  0.059800  1
  C  C78  1  0.537223  0.458239  0.056185  1
  C  C79  1  0.536582  0.958465  0.059812  1
  C  C80  1  0.186344  0.344290  0.116253  1
  C  C81  1  0.186309  0.844824  0.115176  1
  C  C82  1  0.686445  0.344120  0.111110  1
  C  C83  1  0.686304  0.844860  0.115237  1
  C  C84  1  0.122957  0.286996  0.669403  1
  C  C85  1  0.122865  0.788940  0.669526  1
  C  C86  1  0.623025  0.287084  0.669351  1
  C  C87  1  0.622846  0.788850  0.669363  1
  C  C88  1  0.248320  0.125566  0.793966  1
  C  C89  1  0.247791  0.623898  0.794517  1
  C  C90  1  0.748322  0.125552  0.793939  1
  C  C91  1  0.751987  0.628526  0.796254  1
  C  C92  1  0.075922  0.339916  0.307402  1
  C  C93  1  0.075740  0.840306  0.307134  1
  C  C94  1  0.575814  0.340047  0.307335  1
  C  C95  1  0.575710  0.840294  0.307028  1
  C  C96  1  0.310173  0.343838  0.113512  1
  C  C97  1  0.310346  0.844826  0.115174  1
  C  C98  1  0.810422  0.344000  0.112895  1
  C  C99  1  0.810342  0.844858  0.115238  1
  C  C100  1  0.210180  0.207588  0.403071  1
  C  C101  1  0.210049  0.708396  0.403734  1
  C  C102  1  0.710181  0.207758  0.402906  1
  C  C103  1  0.710026  0.708396  0.403602  1
  C  C104  1  0.122962  0.350833  0.616572  1
  C  C105  1  0.122870  0.852570  0.616249  1
  C  C106  1  0.622983  0.350940  0.616558  1
  C  C107  1  0.622843  0.852505  0.616139  1
  C  C108  1  0.060479  0.393962  0.614994  1
  C  C109  1  0.060360  0.895654  0.614350  1
  C  C110  1  0.560454  0.394006  0.615024  1
  C  C111  1  0.560320  0.895572  0.614262  1
  C  C112  1  0.330560  0.148653  0.427691  1
  C  C113  1  0.330405  0.649506  0.428659  1
  C  C114  1  0.830510  0.148760  0.427565  1
  C  C115  1  0.830387  0.649609  0.428898  1
  C  C116  1  0.075952  0.403446  0.444201  1
  C  C117  1  0.075775  0.904400  0.443471  1
  C  C118  1  0.575830  0.403514  0.444208  1
  C  C119  1  0.575736  0.904357  0.443388  1
  C  C120  1  0.036712  0.096400  0.603351  1
  C  C121  1  0.036657  0.598036  0.604988  1
  C  C122  1  0.536881  0.096420  0.603303  1
  C  C123  1  0.536659  0.597948  0.604697  1
  C  C124  1  0.249551  0.426365  0.221682  1
  C  C125  1  0.248327  0.927508  0.221371  1
  C  C126  1  0.747595  0.425614  0.219812  1
  C  C127  1  0.748325  0.927559  0.221405  1
  C  C128  1  0.459987  0.066713  0.435963  1
  C  C129  1  0.459795  0.567565  0.437573  1
  C  C130  1  0.959872  0.066717  0.435961  1
  C  C131  1  0.959781  0.567624  0.437860  1
  C  C132  1  0.080416  0.090064  0.927662  1
  C  C133  1  0.081419  0.590386  0.930375  1
  C  C134  1  0.580416  0.090072  0.927644  1
  C  C135  1  0.583340  0.592625  0.926889  1
  C  C136  1  0.122960  0.137059  0.346149  1
  C  C137  1  0.122831  0.637614  0.347413  1
  C  C138  1  0.622979  0.137190  0.346041  1
  C  C139  1  0.622845  0.637589  0.347148  1
  C  C140  1  0.209810  0.172057  0.935963  1
  C  C141  1  0.210976  0.671370  0.937054  1
  C  C142  1  0.709814  0.172064  0.935924  1
  C  C143  1  0.712374  0.673696  0.938748  1
  C  C144  1  0.325765  0.154245  0.018479  1
  C  C145  1  0.327373  0.652832  0.018574  1
  C  C146  1  0.825769  0.154260  0.018443  1
  C  C147  1  0.827350  0.654598  0.022790  1
  C  C148  1  0.390506  0.378514  0.944664  1
  C  C149  1  0.386987  0.881014  0.946432  1
  C  C150  1  0.888494  0.381792  0.946044  1
  C  C151  1  0.886984  0.881017  0.946475  1
  C  C152  1  0.075789  0.148036  0.655319  1
  C  C153  1  0.075741  0.649886  0.656567  1
  C  C154  1  0.575943  0.148074  0.655259  1
  C  C155  1  0.575722  0.649830  0.656247  1
  C  C156  1  0.137045  0.169771  0.601656  1
  C  C157  1  0.136964  0.671410  0.602689  1
  C  C158  1  0.637156  0.169862  0.601550  1
  C  C159  1  0.636959  0.671368  0.602405  1
  C  C160  1  0.460063  0.031095  0.903061  1
  C  C161  1  0.463968  0.532918  0.901406  1
  C  C162  1  0.960064  0.031092  0.903060  1
  C  C163  1  0.961362  0.531654  0.907178  1
  C  C164  1  0.359849  0.169776  0.601666  1
  C  C165  1  0.359657  0.671326  0.602502  1
  C  C166  1  0.859734  0.169869  0.601559  1
  C  C167  1  0.859654  0.671460  0.602707  1
  C  C168  1  0.248321  0.062025  0.741486  1
  C  C169  1  0.246292  0.560483  0.742877  1
  C  C170  1  0.748321  0.062002  0.741477  1
  C  C171  1  0.752186  0.565557  0.742528  1
  C  C172  1  0.137152  0.357708  0.446309  1
  C  C173  1  0.136986  0.858684  0.445896  1
  C  C174  1  0.637063  0.357816  0.446246  1
  C  C175  1  0.636957  0.858654  0.445795  1
  C  C176  1  0.170907  0.090761  0.155325  1
  C  C177  1  0.172905  0.590270  0.156975  1
  C  C178  1  0.670907  0.090800  0.155304  1
  C  C179  1  0.671169  0.589787  0.155778  1
  C  C180  1  0.210194  0.280277  0.559768  1
  C  C181  1  0.210048  0.781747  0.559868  1
  C  C182  1  0.710186  0.280419  0.559606  1
  C  C183  1  0.710070  0.781751  0.559767  1
  C  C184  1  0.187837  0.471329  0.221358  1
  C  C185  1  0.186306  0.972048  0.220260  1
  C  C186  1  0.685699  0.470323  0.218563  1
  C  C187  1  0.686303  0.972100  0.220275  1
  C  C188  1  0.286711  0.280289  0.559807  1
  C  C189  1  0.286565  0.781702  0.559796  1
  C  C190  1  0.786703  0.280422  0.559594  1
  C  C191  1  0.786587  0.781810  0.559896  1
  C  C192  1  0.460026  0.391622  0.359419  1
  C  C193  1  0.459935  0.892146  0.358626  1
  C  C194  1  0.960161  0.391614  0.359300  1
  C  C195  1  0.959973  0.892189  0.358715  1
  C  C196  1  0.109660  0.108525  0.016424  1
  C  C197  1  0.111062  0.608695  0.018966  1
  C  C198  1  0.609661  0.108545  0.016400  1
  C  C199  1  0.611438  0.609711  0.016656  1
  C  C200  1  0.330532  0.339265  0.535175  1
  C  C201  1  0.330400  0.840567  0.534730  1
  C  C202  1  0.830560  0.339373  0.534967  1
  C  C203  1  0.830423  0.840675  0.534837  1
  C  C204  1  0.416216  0.001265  0.119253  1
  C  C205  1  0.417081  0.499100  0.117994  1
  C  C206  1  0.916220  0.001289  0.119253  1
  C  C207  1  0.916505  0.500243  0.121986  1
  C  C208  1  0.373881  0.200963  0.293377  1
  C  C209  1  0.373746  0.701238  0.293960  1
  C  C210  1  0.873921  0.201003  0.293257  1
  C  C211  1  0.873767  0.701287  0.294177  1
  C  C212  1  0.436483  0.266755  0.720213  1
  C  C213  1  0.436295  0.768783  0.720332  1
  C  C214  1  0.936378  0.266822  0.720127  1
  C  C215  1  0.936308  0.768935  0.720486  1
  C  C216  1  0.325742  0.090767  0.155329  1
  C  C217  1  0.327681  0.589288  0.155459  1
  C  C218  1  0.825745  0.090799  0.155305  1
  C  C219  1  0.825933  0.589545  0.158428  1
  C  C220  1  0.060428  0.093997  0.347697  1
  C  C221  1  0.060307  0.594549  0.349336  1
  C  C222  1  0.560483  0.094079  0.347629  1
  C  C223  1  0.560320  0.594524  0.349058  1
  C  C224  1  0.166360  0.250396  0.343568  1
  C  C225  1  0.166198  0.750950  0.343947  1
  C  C226  1  0.666310  0.250557  0.343458  1
  C  C227  1  0.666181  0.750944  0.343799  1
  C  C228  1  0.122996  0.200913  0.293352  1
  C  C229  1  0.122838  0.701239  0.294127  1
  C  C230  1  0.622954  0.201054  0.293266  1
  C  C231  1  0.622840  0.701245  0.293929  1
  C  C232  1  0.386983  0.108528  0.016421  1
  C  C233  1  0.388408  0.607006  0.016186  1
  C  C234  1  0.886986  0.108542  0.016397  1
  C  C235  1  0.888390  0.608664  0.020797  1
  C  C236  1  0.123787  0.101625  0.846132  1
  C  C237  1  0.123538  0.602188  0.847939  1
  C  C238  1  0.623788  0.101620  0.846111  1
  C  C239  1  0.627057  0.604618  0.845945  1
  C  C240  1  0.207638  0.444274  0.744242  1
  C  C241  1  0.209813  0.946109  0.749364  1
  C  C242  1  0.713282  0.449510  0.747521  1
  C  C243  1  0.709810  0.946087  0.749384  1
  C  C244  1  0.124863  0.451595  0.171205  1
  C  C245  1  0.123784  0.951775  0.169491  1
  C  C246  1  0.623694  0.450775  0.166255  1
  C  C247  1  0.623780  0.951822  0.169512  1
  C  C248  1  0.037002  0.421299  0.526691  1
  C  C249  1  0.036850  0.922596  0.525847  1
  C  C250  1  0.536916  0.421328  0.526741  1
  C  C251  1  0.536805  0.922529  0.525769  1
  C  C252  1  0.460643  0.455976  0.058273  1
  C  C253  1  0.460065  0.958451  0.059795  1
  C  C254  1  0.960687  0.458058  0.062171  1
  C  C255  1  0.960067  0.958460  0.059812  1
  C  C256  1  0.170024  0.398272  0.807630  1
  C  C257  1  0.170904  0.898769  0.807528  1
  C  C258  1  0.673931  0.401485  0.804148  1
  C  C259  1  0.670898  0.898753  0.807554  1
  C  C260  1  0.310341  0.017483  0.742597  1
  C  C261  1  0.308403  0.512258  0.741464  1
  C  C262  1  0.810341  0.017460  0.742601  1
  C  C263  1  0.813946  0.520667  0.743441  1
  C  C264  1  0.060417  0.266775  0.720172  1
  C  C265  1  0.060348  0.768914  0.720480  1
  C  C266  1  0.560524  0.266797  0.720154  1
  C  C267  1  0.560332  0.768797  0.720305  1
  C  C268  1  0.373928  0.350848  0.616678  1
  C  C269  1  0.373770  0.852483  0.616170  1
  C  C270  1  0.873921  0.350947  0.616504  1
  C  C271  1  0.873796  0.852608  0.616271  1
  C  C272  1  0.170877  0.154243  0.018481  1
  C  C273  1  0.172625  0.653980  0.020208  1
  C  C274  1  0.670879  0.154262  0.018445  1
  C  C275  1  0.672777  0.655252  0.020477  1
  C  C276  1  0.286835  0.043424  0.213491  1
  C  C277  1  0.288815  0.542087  0.213846  1
  C  C278  1  0.786835  0.043470  0.213484  1
  C  C279  1  0.786407  0.541570  0.214940  1
  C  C280  1  0.286697  0.207607  0.403092  1
  C  C281  1  0.286566  0.708377  0.403634  1
  C  C282  1  0.786698  0.207736  0.402907  1
  C  C283  1  0.786542  0.708449  0.403761  1
  C  C284  1  0.330584  0.237494  0.619261  1
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