# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.82095735
_cell_length_b   34.55094872
_cell_length_c   45.71680469
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   85.99804701
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C450
_cell_volume   7596.41861411
_cell_formula_units_Z   450
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  0.890587  0.573987  0.293535  1
  C  C2  1  0.190603  0.640745  0.295097  1
  C  C3  1  0.493693  0.706597  0.297665  1
  C  C4  1  0.450454  0.792849  0.300457  1
  C  C5  1  0.189136  0.593584  0.294198  1
  C  C6  1  0.400464  0.839954  0.301933  1
  C  C7  1  0.792283  0.726188  0.298204  1
  C  C8  1  0.769304  0.773492  0.299740  1
  C  C9  1  0.492118  0.659496  0.295672  1
  C  C10  1  0.081658  0.859323  0.302393  1
  C  C11  1  0.058162  0.906658  0.303810  1
  C  C12  1  0.363255  0.972980  0.305810  1
  C  C13  1  0.146260  0.044626  0.275487  1
  C  C14  1  0.116761  0.127716  0.280199  1
  C  C15  1  0.358255  0.925830  0.304464  1
  C  C16  1  0.065874  0.174805  0.281494  1
  C  C17  1  0.452923  0.060811  0.277434  1
  C  C18  1  0.435031  0.108153  0.279303  1
  C  C19  1  0.036094  0.018982  0.247205  1
  C  C20  1  0.746530  0.194020  0.281979  1
  C  C21  1  0.723482  0.241330  0.283345  1
  C  C22  1  0.023509  0.308065  0.284904  1
  C  C23  1  0.326432  0.373909  0.287466  1
  C  C24  1  0.282822  0.460187  0.290240  1
  C  C25  1  0.022111  0.260905  0.284018  1
  C  C26  1  0.232674  0.507289  0.291685  1
  C  C27  1  0.624979  0.393512  0.288003  1
  C  C28  1  0.601650  0.440814  0.289525  1
  C  C29  1  0.325060  0.326806  0.285479  1
  C  C30  1  0.913848  0.526678  0.292158  1
  C  C31  1  0.377785  0.573795  0.321905  1
  C  C32  1  0.678414  0.640287  0.323760  1
  C  C33  1  0.979538  0.706645  0.326063  1
  C  C34  1  0.937994  0.789968  0.328739  1
  C  C35  1  0.704792  0.590482  0.322490  1
  C  C36  1  0.914576  0.839806  0.330298  1
  C  C37  1  0.306583  0.723330  0.326495  1
  C  C38  1  0.281384  0.773159  0.328184  1
  C  C39  1  0.005839  0.656868  0.324267  1
  C  C40  1  0.571113  0.856571  0.330777  1
  C  C41  1  0.547079  0.906441  0.332270  1
  C  C42  1  0.846769  0.973357  0.333840  1
  C  C43  1  0.643123  0.040551  0.305188  1
  C  C44  1  0.604226  0.124512  0.308254  1
  C  C45  1  0.873311  0.923290  0.332742  1
  C  C46  1  0.579847  0.174375  0.309857  1
  C  C47  1  0.973176  0.057723  0.305520  1
  C  C48  1  0.947016  0.107705  0.307742  1
  C  C49  1  0.660424  0.992373  0.306144  1
  C  C50  1  0.236625  0.191277  0.310383  1
  C  C51  1  0.210764  0.241116  0.311728  1
  C  C52  1  0.511312  0.307594  0.313569  1
  C  C53  1  0.812276  0.373952  0.315855  1
  C  C54  1  0.770410  0.457300  0.318517  1
  C  C55  1  0.537812  0.257788  0.312319  1
  C  C56  1  0.746608  0.507121  0.320043  1
  C  C57  1  0.139279  0.390645  0.316292  1
  C  C58  1  0.113823  0.440470  0.317959  1
  C  C59  1  0.838727  0.324174  0.314078  1
  C  C60  1  0.403195  0.523955  0.320519  1
  C  C61  1  0.881224  0.571881  0.352721  1
  C  C62  1  0.181045  0.638466  0.354576  1
  C  C63  1  0.481671  0.704795  0.356784  1
  C  C64  1  0.439761  0.788564  0.359459  1
  C  C65  1  0.204286  0.589036  0.353222  1
  C  C66  1  0.413751  0.837979  0.361001  1
  C  C67  1  0.804739  0.721946  0.357328  1
  C  C68  1  0.780009  0.771390  0.358933  1
  C  C69  1  0.504863  0.655382  0.355092  1
  C  C70  1  0.073698  0.855206  0.361516  1
  C  C71  1  0.049044  0.904710  0.362918  1
  C  C72  1  0.348623  0.971342  0.364746  1
  C  C73  1  0.147589  0.039715  0.336047  1
  C  C74  1  0.104968  0.123080  0.338970  1
  C  C75  1  0.372111  0.921877  0.363467  1
  C  C76  1  0.079386  0.172468  0.340556  1
  C  C77  1  0.469721  0.056635  0.336948  1
  C  C78  1  0.445708  0.105825  0.338482  1
  C  C79  1  0.174297  0.990183  0.334532  1
  C  C80  1  0.739131  0.189675  0.341081  1
  C  C81  1  0.714190  0.239126  0.342535  1
  C  C82  1  0.013878  0.305740  0.344382  1
  C  C83  1  0.314394  0.372075  0.346574  1
  C  C84  1  0.272336  0.455853  0.349234  1
  C  C85  1  0.037152  0.256307  0.343048  1
  C  C86  1  0.246318  0.505252  0.350748  1
  C  C87  1  0.637445  0.389231  0.347124  1
  C  C88  1  0.612597  0.438670  0.348708  1
  C  C89  1  0.337675  0.322662  0.344902  1
  C  C90  1  0.906057  0.522435  0.351277  1
  C  C91  1  0.381183  0.570343  0.382856  1
  C  C92  1  0.681194  0.636887  0.384815  1
  C  C93  1  0.981419  0.703309  0.386960  1
  C  C94  1  0.939636  0.786910  0.389591  1
  C  C95  1  0.706120  0.587295  0.383391  1
  C  C96  1  0.915353  0.836491  0.391105  1
  C  C97  1  0.306344  0.720263  0.387455  1
  C  C98  1  0.281390  0.769879  0.389059  1
  C  C99  1  0.006326  0.653726  0.385328  1
  C  C100  1  0.573592  0.853512  0.391637  1
  C  C101  1  0.548795  0.903152  0.393069  1
  C  C102  1  0.848056  0.969767  0.394874  1
  C  C103  1  0.646898  0.037808  0.366434  1
  C  C104  1  0.605401  0.121368  0.369170  1
  C  C105  1  0.873551  0.920148  0.393579  1
  C  C106  1  0.580927  0.170905  0.370688  1
  C  C107  1  0.972239  0.054740  0.366877  1
  C  C108  1  0.947074  0.104293  0.368587  1
  C  C109  1  0.671875  0.988290  0.365214  1
  C  C110  1  0.239110  0.187945  0.371206  1
  C  C111  1  0.214100  0.237562  0.372664  1
  C  C112  1  0.513988  0.304124  0.374614  1
  C  C113  1  0.814136  0.370558  0.376747  1
  C  C114  1  0.772324  0.454144  0.379374  1
  C  C115  1  0.538985  0.254530  0.373198  1
  C  C116  1  0.747930  0.503708  0.380893  1
  C  C117  1  0.139061  0.387515  0.377250  1
  C  C118  1  0.114129  0.437125  0.378836  1
  C  C119  1  0.839081  0.320975  0.375133  1
  C  C120  1  0.406120  0.520726  0.381401  1
  C  C121  1  0.882508  0.568664  0.413236  1
  C  C122  1  0.182305  0.635219  0.415213  1
  C  C123  1  0.482316  0.701672  0.417312  1
  C  C124  1  0.440537  0.785323  0.419929  1
  C  C125  1  0.206806  0.585684  0.413748  1
  C  C126  1  0.415803  0.834837  0.421444  1
  C  C127  1  0.806590  0.718697  0.417836  1
  C  C128  1  0.781794  0.768255  0.419400  1
  C  C129  1  0.506813  0.652142  0.415729  1
  C  C130  1  0.074573  0.851917  0.421969  1
  C  C131  1  0.049708  0.901489  0.423406  1
  C  C132  1  0.349106  0.968071  0.425287  1
  C  C133  1  0.147730  0.036256  0.396789  1
  C  C134  1  0.106155  0.119740  0.399478  1
  C  C135  1  0.373939  0.918527  0.423933  1
  C  C136  1  0.081472  0.169227  0.401022  1
  C  C137  1  0.472239  0.053153  0.397401  1
  C  C138  1  0.447504  0.102676  0.398964  1
  C  C139  1  0.173049  0.986698  0.395438  1
  C  C140  1  0.740219  0.186317  0.401553  1
  C  C141  1  0.715377  0.235869  0.403036  1
  C  C142  1  0.015082  0.302436  0.405009  1
  C  C143  1  0.315041  0.368894  0.407101  1
  C  C144  1  0.273289  0.452537  0.409714  1
  C  C145  1  0.039647  0.252900  0.403550  1
  C  C146  1  0.248561  0.502042  0.411232  1
  C  C147  1  0.639327  0.385918  0.407630  1
  C  C148  1  0.614558  0.435470  0.409189  1
  C  C149  1  0.339571  0.319365  0.405526  1
  C  C150  1  0.907288  0.519108  0.411755  1
  C  C151  1  0.383284  0.567038  0.443534  1
  C  C152  1  0.683055  0.633592  0.445544  1
  C  C153  1  0.982938  0.700067  0.447617  1
  C  C154  1  0.941194  0.783700  0.450212  1
  C  C155  1  0.707737  0.584042  0.444056  1
  C  C156  1  0.916626  0.833224  0.451721  1
  C  C157  1  0.307378  0.717075  0.448132  1
  C  C158  1  0.282587  0.766646  0.449682  1
  C  C159  1  0.007633  0.650520  0.446060  1
  C  C160  1  0.575225  0.850274  0.452252  1
  C  C161  1  0.550360  0.899853  0.453708  1
  C  C162  1  0.849775  0.966416  0.455598  1
  C  C163  1  0.648617  0.034545  0.427183  1
  C  C164  1  0.606945  0.118104  0.429792  1
  C  C165  1  0.874780  0.916861  0.454223  1
  C  C166  1  0.582324  0.167614  0.431312  1
  C  C167  1  0.973236  0.051504  0.427686  1
  C  C168  1  0.948377  0.101059  0.429242  1
  C  C169  1  0.673512  0.985003  0.425794  1
  C  C170  1  0.240907  0.184665  0.431832  1
  C  C171  1  0.216128  0.234233  0.433330  1
  C  C172  1  0.515827  0.300795  0.435337  1
  C  C173  1  0.815695  0.367273  0.437408  1
  C  C174  1  0.773996  0.450898  0.440002  1
  C  C175  1  0.540557  0.251247  0.433853  1
  C  C176  1  0.749439  0.500418  0.441522  1
  C  C177  1  0.140141  0.384280  0.437925  1
  C  C178  1  0.115397  0.433849  0.439473  1
  C  C179  1  0.840398  0.317727  0.435855  1
  C  C180  1  0.408035  0.517466  0.442039  1
  C  C181  1  0.884158  0.565402  0.473857  1
  C  C182  1  0.183872  0.631955  0.475881  1
  C  C183  1  0.483672  0.698444  0.477933  1
  C  C184  1  0.441947  0.782075  0.480515  1
  C  C185  1  0.208561  0.582411  0.474374  1
  C  C186  1  0.417362  0.831590  0.482028  1
  C  C187  1  0.808065  0.715457  0.478454  1
  C  C188  1  0.783311  0.765022  0.479986  1
  C  C189  1  0.508376  0.648901  0.476398  1
  C  C190  1  0.075988  0.848640  0.482554  1
  C  C191  1  0.051139  0.898209  0.484025  1
  C  C192  1  0.350632  0.964754  0.485941  1
  C  C193  1  0.149373  0.032906  0.457516  1
  C  C194  1  0.107678  0.116468  0.460091  1
  C  C195  1  0.375559  0.915206  0.484549  1
  C  C196  1  0.083104  0.165977  0.461614  1
  C  C197  1  0.473883  0.049867  0.458056  1
  C  C198  1  0.449080  0.099427  0.459568  1
  C  C199  1  0.174316  0.983359  0.456125  1
  C  C200  1  0.741736  0.183032  0.462143  1
  C  C201  1  0.716978  0.232596  0.463651  1
  C  C202  1  0.016651  0.299152  0.465674  1
  C  C203  1  0.316450  0.365642  0.467726  1
  C  C204  1  0.274775  0.449269  0.470305  1
  C  C205  1  0.041375  0.249609  0.464169  1
  C  C206  1  0.250237  0.498784  0.471825  1
  C  C207  1  0.640851  0.382653  0.468247  1
  C  C208  1  0.616136  0.432218  0.469781  1
  C  C209  1  0.341151  0.316100  0.466191  1
  C  C210  1  0.908875  0.515835  0.472347  1
  C  C211  1  0.384944  0.563771  0.504171  1
  C  C212  1  0.684648  0.630326  0.506211  1
  C  C213  1  0.984430  0.696816  0.508247  1
  C  C214  1  0.942707  0.780444  0.510814  1
  C  C215  1  0.709361  0.580780  0.504690  1
  C  C216  1  0.918124  0.829958  0.512328  1
  C  C217  1  0.308840  0.713829  0.508768  1
  C  C218  1  0.284094  0.763395  0.510289  1
  C  C219  1  0.009161  0.647271  0.506728  1
  C  C220  1  0.576720  0.847000  0.512862  1
  C  C221  1  0.551886  0.896566  0.514355  1
  C  C222  1  0.851450  0.963099  0.516273  1
  C  C223  1  0.650225  0.031240  0.487861  1
  C  C224  1  0.608464  0.114834  0.490404  1
  C  C225  1  0.876363  0.913552  0.514870  1
  C  C226  1  0.583881  0.164348  0.491918  1
  C  C227  1  0.974702  0.048226  0.488377  1
  C  C228  1  0.949868  0.097792  0.489870  1
  C  C229  1  0.675138  0.981693  0.486459  1
  C  C230  1  0.242494  0.181397  0.492443  1
  C  C231  1  0.217748  0.230964  0.493964  1
  C  C232  1  0.517427  0.297521  0.496004  1
  C  C233  1  0.817227  0.364012  0.498042  1
  C  C234  1  0.775557  0.447638  0.500606  1
  C  C235  1  0.542158  0.247976  0.494484  1
  C  C236  1  0.751031  0.497155  0.502126  1
  C  C237  1  0.141644  0.381022  0.498561  1
  C  C238  1  0.116935  0.430590  0.500083  1
  C  C239  1  0.841940  0.314467  0.496521  1
  C  C240  1  0.409653  0.514203  0.502649  1
  C  C241  1  0.885737  0.562140  0.534484  1
  C  C242  1  0.185437  0.628693  0.536540  1
  C  C243  1  0.485213  0.695184  0.538563  1
  C  C244  1  0.443484  0.778816  0.541118  1
  C  C245  1  0.210138  0.579150  0.535006  1
  C  C246  1  0.418910  0.828324  0.542640  1
  C  C247  1  0.809610  0.712197  0.539081  1
  C  C248  1  0.784852  0.761760  0.540589  1
  C  C249  1  0.509937  0.645640  0.537058  1
  C  C250  1  0.077508  0.845366  0.543164  1
  C  C251  1  0.052705  0.894925  0.544676  1
  C  C252  1  0.352272  0.961434  0.546607  1
  C  C253  1  0.151029  0.029586  0.518182  1
  C  C254  1  0.109226  0.113202  0.520703  1
  C  C255  1  0.377215  0.911887  0.545216  1
  C  C256  1  0.084641  0.162718  0.522217  1
  C  C257  1  0.475449  0.046584  0.518707  1
  C  C258  1  0.450600  0.096153  0.520178  1
  C  C259  1  0.175956  0.980039  0.516790  1
  C  C260  1  0.743277  0.179770  0.522746  1
  C  C261  1  0.718523  0.229336  0.524278  1
  C  C262  1  0.018212  0.295891  0.526334  1
  C  C263  1  0.318027  0.362381  0.528358  1
  C  C264  1  0.276351  0.446008  0.530907  1
  C  C265  1  0.042916  0.246348  0.524798  1
  C  C266  1  0.251813  0.495523  0.532427  1
  C  C267  1  0.642430  0.379391  0.528875  1
  C  C268  1  0.617713  0.428958  0.530384  1
  C  C269  1  0.342716  0.312837  0.526851  1
  C  C270  1  0.910452  0.512574  0.532950  1
  C  C271  1  0.386447  0.560512  0.564806  1
  C  C272  1  0.686190  0.627065  0.566877  1
  C  C273  1  0.986031  0.693546  0.568879  1
  C  C274  1  0.944264  0.777179  0.571419  1
  C  C275  1  0.710894  0.577520  0.565323  1
  C  C276  1  0.919643  0.826688  0.572940  1
  C  C277  1  0.310460  0.710560  0.569402  1
  C  C278  1  0.285681  0.760127  0.570899  1
  C  C279  1  0.010761  0.643997  0.567395  1
  C  C280  1  0.578211  0.843733  0.573489  1
  C  C281  1  0.553352  0.893289  0.575046  1
  C  C282  1  0.853076  0.959790  0.576937  1
  C  C283  1  0.651808  0.027931  0.548508  1
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