# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   17.11584298
_cell_length_b   18.37800029
_cell_length_c   48.85756933
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   72.07978686
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C864
_cell_volume   14622.8076696
_cell_formula_units_Z   864
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  0.208295  0.093684  0.218365  1
  C  C2  1  0.541629  0.760350  0.218364  1
  C  C3  1  0.466617  0.073464  0.277148  1
  C  C4  1  0.861205  0.098145  0.251937  1
  C  C5  1  0.194539  0.764812  0.251937  1
  C  C6  1  0.527870  0.431480  0.251935  1
  C  C7  1  0.874960  0.427016  0.218363  1
  C  C8  1  0.799952  0.740129  0.277149  1
  C  C9  1  0.133289  0.406807  0.277142  1
  C  C10  1  0.057618  0.385204  0.262124  1
  C  C11  1  0.390957  0.051878  0.262127  1
  C  C12  1  0.441411  0.440016  0.234465  1
  C  C13  1  0.680466  0.364241  0.295964  1
  C  C14  1  1.013802  0.030923  0.295969  1
  C  C15  1  0.347135  0.697589  0.295969  1
  C  C16  1  0.724294  0.718541  0.262128  1
  C  C17  1  0.774743  0.106683  0.234465  1
  C  C18  1  0.108074  0.773352  0.234465  1
  C  C19  1  0.950198  0.092451  0.241959  1
  C  C20  1  0.283534  0.759118  0.241958  1
  C  C21  1  0.171869  0.045223  0.305054  1
  C  C22  1  0.532935  0.084974  0.254087  1
  C  C23  1  0.866263  0.751642  0.254087  1
  C  C24  1  0.199602  0.418307  0.254088  1
  C  C25  1  0.616861  0.425786  0.241957  1
  C  C26  1  0.505202  0.711891  0.305053  1
  C  C27  1  0.838540  0.378550  0.305053  1
  C  C28  1  0.916806  0.352989  0.325445  1
  C  C29  1  0.250094  0.019748  0.325397  1
  C  C30  1  0.298722  0.385323  0.262196  1
  C  C31  1  0.685795  0.405990  0.264113  1
  C  C32  1  0.019126  0.072658  0.264121  1
  C  C33  1  0.352460  0.739326  0.264122  1
  C  C34  1  0.583428  0.686418  0.325393  1
  C  C35  1  0.632048  0.051991  0.262194  1
  C  C36  1  0.965376  0.718658  0.262194  1
  C  C37  1  1.016690  0.193530  0.300663  1
  C  C38  1  0.350028  0.860193  0.300664  1
  C  C39  1  0.396612  0.244025  0.252023  1
  C  C40  1  0.790795  0.274833  0.231376  1
  C  C41  1  0.124125  0.941501  0.231374  1
  C  C42  1  0.457460  0.608167  0.231375  1
  C  C43  1  0.683366  0.526866  0.300661  1
  C  C44  1  0.729942  0.910690  0.252021  1
  C  C45  1  0.063277  0.577359  0.252023  1
  C  C46  1  0.216497  0.261741  0.232794  1
  C  C47  1  0.549830  0.928408  0.232793  1
  C  C48  1  0.460670  0.237097  0.278390  1
  C  C49  1  0.841970  0.257271  0.262287  1
  C  C50  1  0.175306  0.923940  0.262285  1
  C  C51  1  0.508636  0.590606  0.262285  1
  C  C52  1  0.883164  0.595074  0.232795  1
  C  C53  1  0.794005  0.903766  0.278389  1
  C  C54  1  0.127341  0.570430  0.278391  1
  C  C55  1  0.927324  0.177959  0.308232  1
  C  C56  1  0.260662  0.844627  0.308232  1
  C  C57  1  0.300694  0.193852  0.285753  1
  C  C58  1  0.672405  0.241517  0.266752  1
  C  C59  1  1.005741  0.908182  0.266754  1
  C  C60  1  0.339072  0.574850  0.266755  1
  C  C61  1  0.593984  0.511283  0.308236  1
  C  C62  1  0.634031  0.860516  0.285753  1
  C  C63  1  0.967364  0.527181  0.285753  1
  C  C64  1  0.840409  0.228127  0.294573  1
  C  C65  1  0.173733  0.894792  0.294577  1
  C  C66  1  0.228483  0.250168  0.267096  1
  C  C67  1  0.605916  0.270980  0.241967  1
  C  C68  1  0.939252  0.937645  0.241968  1
  C  C69  1  0.272588  0.604309  0.241970  1
  C  C70  1  0.507050  0.561467  0.294575  1
  C  C71  1  0.561817  0.916837  0.267095  1
  C  C72  1  0.895139  0.583506  0.267095  1
  C  C73  1  0.988778  0.269084  0.277130  1
  C  C74  1  0.322106  0.935746  0.277129  1
  C  C75  1  0.358303  0.331285  0.239149  1
  C  C76  1  0.603746  0.266803  0.322161  1
  C  C77  1  0.937088  0.933462  0.322159  1
  C  C78  1  0.270423  0.600127  0.322160  1
  C  C79  1  0.655445  0.602422  0.277127  1
  C  C80  1  0.691634  -0.002044  0.239150  1
  C  C81  1  0.024969  0.664621  0.239149  1
  C  C82  1  0.926403  0.266414  0.254106  1
  C  C83  1  0.259739  0.933082  0.254106  1
  C  C84  1  0.152613  0.220411  0.318780  1
  C  C85  1  0.526260  0.258174  0.258156  1
  C  C86  1  0.859600  0.924842  0.258155  1
  C  C87  1  0.192930  0.591509  0.258155  1
  C  C88  1  0.593071  0.599748  0.254105  1
  C  C89  1  0.485939  0.887073  0.318782  1
  C  C90  1  0.819295  0.553751  0.318778  1
  C  C91  1  0.069240  0.294878  0.268897  1
  C  C92  1  0.402577  0.961548  0.268896  1
  C  C93  1  0.428485  0.360602  0.223507  1
  C  C94  1  0.676166  0.269482  0.299327  1
  C  C95  1  1.009506  0.936161  0.299328  1
  C  C96  1  0.342843  0.602823  0.299326  1
  C  C97  1  0.735908  0.628216  0.268897  1
  C  C98  1  0.761814  0.027272  0.223507  1
  C  C99  1  0.095148  0.693935  0.223507  1
  C  C100  1  0.151821  0.249740  0.286695  1
  C  C101  1  0.485152  0.916408  0.286693  1
  C  C102  1  0.516741  0.291888  0.226590  1
  C  C103  1  0.766175  0.219409  0.313876  1
  C  C104  1  0.099503  0.886078  0.313876  1
  C  C105  1  0.432833  0.552746  0.313876  1
  C  C106  1  0.818491  0.583072  0.286695  1
  C  C107  1  0.850068  0.958554  0.226588  1
  C  C108  1  0.183402  0.625221  0.226589  1
  C  C109  1  0.892782  0.432590  0.251982  1
  C  C110  1  0.226107  0.099258  0.251990  1
  C  C111  1  0.132769  0.386594  0.309846  1
  C  C112  1  0.519313  0.408868  0.284898  1
  C  C113  1  0.852645  0.075537  0.284895  1
  C  C114  1  0.185983  0.742203  0.284895  1
  C  C115  1  0.559440  0.765924  0.251990  1
  C  C116  1  0.466104  0.053263  0.309847  1
  C  C117  1  0.799437  0.719930  0.309848  1
  C  C118  1  0.922541  0.091187  0.304706  1
  C  C119  1  0.255880  0.757850  0.304706  1
  C  C120  1  0.301955  0.116576  0.268031  1
  C  C121  1  0.705832  0.152703  0.256821  1
  C  C122  1  0.039163  0.819369  0.256822  1
  C  C123  1  0.372495  0.486040  0.256822  1
  C  C124  1  0.589175  0.424537  0.304709  1
  C  C125  1  0.635291  0.783242  0.268031  1
  C  C126  1  0.968633  0.449914  0.268034  1
  C  C127  1  0.159604  0.453311  0.225451  1
  C  C128  1  0.492937  0.119977  0.225454  1
  C  C129  1  0.436384  0.397001  0.298125  1
  C  C130  1  0.827029  0.425466  0.275309  1
  C  C131  1  0.160363  0.092126  0.275312  1
  C  C132  1  0.493695  0.758795  0.275311  1
  C  C133  1  0.826271  0.786643  0.225456  1
  C  C134  1  0.769728  0.063668  0.298124  1
  C  C135  1  0.103060  0.730334  0.298124  1
  C  C136  1  0.062394  0.135889  0.274421  1
  C  C137  1  0.395724  0.802557  0.274422  1
  C  C138  1  0.412334  0.183843  0.227381  1
  C  C139  1  0.684884  0.095627  0.280060  1
  C  C140  1  0.018214  0.762299  0.280059  1
  C  C141  1  0.351564  0.428957  0.280063  1
  C  C142  1  0.729052  0.469236  0.274420  1
  C  C143  1  0.745669  0.850509  0.227382  1
  C  C144  1  0.078997  0.517178  0.227381  1
  C  C145  1  0.086721  0.034982  0.317652  1
  C  C146  1  0.420048  0.701648  0.317653  1
  C  C147  1  0.331747  -0.022025  0.375909  1
  C  C148  1  0.700219  0.010013  0.344150  1
  C  C149  1  0.033550  0.676681  0.344149  1
  C  C150  1  0.366897  0.343344  0.344152  1
  C  C151  1  0.753384  0.368323  0.317647  1
  C  C152  1  0.665091  0.644641  0.375913  1
  C  C153  1  0.998286  0.311317  0.375875  1
  C  C154  1  0.920613  0.305019  0.355495  1
  C  C155  1  0.253976  0.971655  0.355484  1
  C  C156  1  0.302531  0.318921  0.323600  1
  C  C157  1  0.547618  0.254780  0.394674  1
  C  C158  1  0.880963  0.921441  0.394675  1
  C  C159  1  0.214296  0.588107  0.394676  1
  C  C160  1  0.587313  0.638316  0.355482  1
  C  C161  1  0.635855  -0.014410  0.323599  1
  C  C162  1  0.969184  0.652257  0.323598  1
  C  C163  1  0.778613  0.026499  0.329090  1
  C  C164  1  0.111953  0.693163  0.329091  1
  C  C165  1  0.035214  0.950289  0.396096  1
  C  C166  1  0.406140  -0.001872  0.360023  1
  C  C167  1  0.739480  0.664795  0.360021  1
  C  C168  1  0.072816  0.331465  0.360023  1
  C  C169  1  0.445276  0.359830  0.329090  1
  C  C170  1  0.368550  0.616955  0.396096  1
  C  C171  1  0.701881  0.283626  0.396098  1
  C  C172  1  0.801454  0.245752  0.399481  1
  C  C173  1  0.134773  0.912438  0.399480  1
  C  C174  1  0.169924  0.297804  0.369142  1
  C  C175  1  0.540040  0.332373  0.340814  1
  C  C176  1  0.873383  -0.000955  0.340819  1
  C  C177  1  0.206717  0.665708  0.340817  1
  C  C178  1  0.468104  0.579108  0.399480  1
  C  C179  1  0.503226  0.964487  0.369140  1
  C  C180  1  0.836561  0.631157  0.369142  1
  C  C181  1  0.884044  0.079593  0.393875  1
  C  C182  1  0.217383  0.746257  0.393877  1
  C  C183  1  0.270758  0.147827  0.355241  1
  C  C184  1  0.619754  0.184272  0.337317  1
  C  C185  1  0.953087  0.850945  0.337317  1
  C  C186  1  0.286426  0.517614  0.337317  1
  C  C187  1  0.550715  0.412926  0.393882  1
  C  C188  1  0.604088  0.814497  0.355241  1
  C  C189  1  0.937411  0.481170  0.355240  1
  C  C190  1  0.076337  0.191711  0.328487  1
  C  C191  1  0.409671  0.858380  0.328485  1
  C  C192  1  0.334142  0.137640  0.381000  1
  C  C193  1  0.699663  0.161961  0.358004  1
  C  C194  1  0.033004  0.828629  0.358003  1
  C  C195  1  0.366338  0.495294  0.358005  1
  C  C196  1  0.743004  0.525045  0.328490  1
  C  C197  1  0.667477  0.804307  0.381001  1
  C  C198  1  1.000818  0.470971  0.381004  1
  C  C199  1  0.793800  0.071577  0.401332  1
  C  C200  1  0.127135  0.738244  0.401333  1
  C  C201  1  0.156058  0.113249  0.381596  1
  C  C202  1  0.554006  0.146720  0.323029  1
  C  C203  1  0.887339  0.813383  0.323029  1
  C  C204  1  0.220670  0.480057  0.323029  1
  C  C205  1  0.460469  0.404915  0.401331  1
  C  C206  1  0.489398  0.779910  0.381597  1
  C  C207  1  0.822735  0.446583  0.381594  1
  C  C208  1  0.706508  0.128076  0.389297  1
  C  C209  1  0.039844  0.794747  0.389295  1
  C  C210  1  0.085364  0.162978  0.360315  1
  C  C211  1  0.469495  0.205153  0.309984  1
  C  C212  1  0.802829  0.871820  0.309985  1
  C  C213  1  0.136159  0.538487  0.309984  1
  C  C214  1  0.373174  0.461411  0.389294  1
  C  C215  1  0.418678  0.829650  0.360316  1
  C  C216  1  0.752011  0.496311  0.360321  1
  C  C217  1  0.833869  0.206845  0.369159  1
  C  C218  1  0.167201  0.873516  0.369157  1
  C  C219  1  0.204743  0.229535  0.346416  1
  C  C220  1  0.453556  0.171031  0.395371  1
  C  C221  1  0.786893  0.837695  0.395371  1
  C  C222  1  0.120225  0.504362  0.395369  1
  C  C223  1  0.500533  0.540182  0.369156  1
  C  C224  1  0.538080  0.896202  0.346417  1
  C  C225  1  0.871406  0.562872  0.346415  1
  C  C226  1  0.777297  0.185224  0.344867  1
  C  C227  1  0.110634  0.851900  0.344871  1
  C  C228  1  0.021263  0.118558  0.408337  1
  C  C229  1  0.407621  0.164365  0.366400  1
  C  C230  1  0.740952  0.831029  0.366399  1
  C  C231  1  0.074292  0.497702  0.366398  1
  C  C232  1  0.443961  0.518567  0.344871  1
  C  C233  1  0.354599  0.785227  0.408338  1
  C  C234  1  0.687937  0.451892  0.408340  1
  C  C235  1  0.923723  0.213242  0.362212  1
  C  C236  1  0.257057  0.879774  0.362225  1
  C  C237  1  0.330527  0.229176  0.313526  1
  C  C238  1  0.550621  0.164410  0.392747  1
  C  C239  1  0.883955  0.831081  0.392746  1
  C  C240  1  0.217285  0.497748  0.392747  1
  C  C241  1  0.590386  0.546429  0.362224  1
  C  C242  1  0.663856  0.895847  0.313525  1
  C  C243  1  0.997193  0.562515  0.313527  1
  C  C244  1  1.004283  0.157262  0.377594  1
  C  C245  1  0.337616  0.823933  0.377595  1
  C  C246  1  0.407601  0.194031  0.334499  1
  C  C247  1  0.634282  0.113031  0.408611  1
  C  C248  1  0.967611  0.779700  0.408609  1
  C  C249  1  0.300951  0.446367  0.408608  1
  C  C250  1  0.670957  0.490594  0.377596  1
  C  C251  1  0.740937  0.860697  0.334499  1
  C  C252  1  0.074271  0.527362  0.334501  1
  C  C253  1  0.753621  0.353681  0.350693  1
  C  C254  1  0.086945  0.020350  0.350690  1
  C  C255  1  1.003928  0.279251  0.407076  1
  C  C256  1  0.373202  0.318649  0.376533  1
  C  C257  1  0.706544  -0.014685  0.376535  1
  C  C258  1  0.039880  0.651982  0.376535  1
  C  C259  1  0.420274  0.687016  0.350690  1
  C  C260  1  0.337257  0.945930  0.407072  1
  C  C261  1  0.670591  0.612596  0.407072  1
  C  C262  1  0.790304  -0.014243  0.393074  1
  C  C263  1  0.123641  0.652418  0.393074  1
  C  C264  1  0.164854  0.031649  0.368008  1
  C  C265  1  0.551512  0.058031  0.324291  1
  C  C266  1  0.884840  0.724693  0.324290  1
  C  C267  1  0.218200  0.391364  0.324296  1
  C  C268  1  0.456970  0.319085  0.393073  1
  C  C269  1  0.498175  0.698326  0.368010  1
  C  C270  1  0.831658  0.364907  0.368000  1
  C  C271  1  0.061013  0.373246  0.329635  1
  C  C272  1  0.394357  0.039912  0.329642  1
  C  C273  1  0.303306  0.297194  0.395080  1
  C  C274  1  0.679687  0.332442  0.367312  1
  C  C275  1  1.013047  -0.000884  0.367309  1
  C  C276  1  0.346383  0.665781  0.367310  1
  C  C277  1  0.727699  0.706579  0.329641  1
  C  C278  1  0.636624  0.963864  0.395081  1
  C  C279  1  0.969955  0.630530  0.395080  1
  C  C280  1  0.914799  0.042649  0.363504  1
  C  C281  1  0.248133  0.709314  0.363505  1
  C  C282  1  0.295302  0.084781  0.329809  1
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