# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.70184049
_cell_length_b   77.53983929
_cell_length_c   49.20117317
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   91.03476075
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C216
_cell_volume   21749.2652354
_cell_formula_units_Z   216
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  0.463253  0.355339  0.296208  1
  C  C2  1  0.546601  0.688902  0.311569  1
  C  C3  1  0.378976  0.018182  0.279576  1
  C  C4  1  0.033758  0.635135  0.307678  1
  C  C5  1  0.117404  0.969780  0.324053  1
  C  C6  1  0.952446  0.310393  0.294325  1
  C  C7  1  0.283776  0.635220  0.294117  1
  C  C8  1  0.367483  0.970095  0.310502  1
  C  C9  1  0.448965  0.295921  0.325980  1
  C  C10  1  0.713109  0.354746  0.309736  1
  C  C11  1  0.548982  0.698482  0.281052  1
  C  C12  1  0.628898  0.017867  0.293128  1
  C  C13  1  0.963254  0.355343  0.296208  1
  C  C14  1  0.045054  0.682575  0.310948  1
  C  C15  1  0.878977  0.018182  0.279576  1
  C  C16  1  0.533763  0.635156  0.307676  1
  C  C17  1  0.617405  0.969780  0.324053  1
  C  C18  1  0.446816  0.287432  0.294672  1
  C  C19  1  0.783783  0.635220  0.294117  1
  C  C20  1  0.867482  0.970095  0.310502  1
  C  C21  1  0.950527  0.302286  0.325883  1
  C  C22  1  0.213105  0.354746  0.309736  1
  C  C23  1  0.043483  0.675676  0.278685  1
  C  C24  1  0.128899  0.017867  0.293128  1
  C  C25  1  0.712731  0.353235  0.344031  1
  C  C26  1  0.795364  0.683809  0.360356  1
  C  C27  1  0.628701  0.017069  0.327481  1
  C  C28  1  0.283687  0.634850  0.358219  1
  C  C29  1  0.367118  0.968615  0.374565  1
  C  C30  1  0.199766  0.299197  0.341476  1
  C  C31  1  0.533714  0.634971  0.342051  1
  C  C32  1  0.617209  0.968982  0.358407  1
  C  C33  1  0.699867  0.299416  0.375115  1
  C  C34  1  0.962555  0.352530  0.360161  1
  C  C35  1  0.795636  0.685110  0.326778  1
  C  C36  1  0.878613  0.016702  0.343640  1
  C  C37  1  0.212726  0.353235  0.344031  1
  C  C38  1  0.295362  0.683805  0.360357  1
  C  C39  1  0.128705  0.017069  0.327481  1
  C  C40  1  0.783679  0.634850  0.358219  1
  C  C41  1  0.867117  0.968615  0.374565  1
  C  C42  1  0.699758  0.299204  0.341476  1
  C  C43  1  0.033711  0.634962  0.342053  1
  C  C44  1  0.117210  0.968982  0.358408  1
  C  C45  1  0.199870  0.299406  0.375115  1
  C  C46  1  0.462556  0.352530  0.360160  1
  C  C47  1  0.295709  0.685110  0.326780  1
  C  C48  1  0.378613  0.016702  0.343640  1
  C  C49  1  0.962190  0.351076  0.393819  1
  C  C50  1  0.044995  0.682160  0.410352  1
  C  C51  1  0.878430  0.015960  0.377355  1
  C  C52  1  0.533552  0.634339  0.408452  1
  C  C53  1  0.616850  0.967527  0.424776  1
  C  C54  1  0.449905  0.299556  0.391675  1
  C  C55  1  0.783601  0.634527  0.391951  1
  C  C56  1  0.866937  0.967873  0.408281  1
  C  C57  1  0.949932  0.299586  0.425176  1
  C  C58  1  0.212024  0.350386  0.410286  1
  C  C59  1  0.045229  0.683272  0.376897  1
  C  C60  1  0.128345  0.015614  0.393850  1
  C  C61  1  0.462191  0.351076  0.393818  1
  C  C62  1  0.544980  0.682092  0.410346  1
  C  C63  1  0.378431  0.015960  0.377355  1
  C  C64  1  0.033552  0.634339  0.408453  1
  C  C65  1  0.116852  0.967527  0.424775  1
  C  C66  1  0.949878  0.299441  0.391675  1
  C  C67  1  0.283595  0.634527  0.391951  1
  C  C68  1  0.366936  0.967873  0.408281  1
  C  C69  1  0.449949  0.299655  0.425176  1
  C  C70  1  0.712018  0.350386  0.410286  1
  C  C71  1  0.545208  0.683159  0.376887  1
  C  C72  1  0.628346  0.015614  0.393850  1
  C  C73  1  0.211686  0.349043  0.443757  1
  C  C74  1  0.294695  0.680904  0.460410  1
  C  C75  1  0.128181  0.014945  0.427370  1
  C  C76  1  0.783358  0.633563  0.458590  1
  C  C77  1  0.866609  0.966540  0.474904  1
  C  C78  1  0.699944  0.299634  0.441817  1
  C  C79  1  0.033436  0.633870  0.441982  1
  C  C80  1  0.116686  0.966858  0.458296  1
  C  C81  1  0.199877  0.299550  0.475274  1
  C  C82  1  0.461540  0.348430  0.460343  1
  C  C83  1  0.294878  0.681662  0.426974  1
  C  C84  1  0.378103  0.014627  0.443979  1
  C  C85  1  0.711697  0.349043  0.443757  1
  C  C86  1  0.794714  0.680904  0.460410  1
  C  C87  1  0.628181  0.014945  0.427370  1
  C  C88  1  0.283363  0.633563  0.458590  1
  C  C89  1  0.366608  0.966540  0.474904  1
  C  C90  1  0.199943  0.299634  0.441817  1
  C  C91  1  0.533436  0.633870  0.441980  1
  C  C92  1  0.616687  0.966858  0.458296  1
  C  C93  1  0.699879  0.299551  0.475274  1
  C  C94  1  0.961541  0.348429  0.460345  1
  C  C95  1  0.794868  0.681662  0.426974  1
  C  C96  1  0.878103  0.014627  0.443978  1
  C  C97  1  0.461275  0.347320  0.493775  1
  C  C98  1  0.544500  0.680182  0.510506  1
  C  C99  1  0.377951  0.014011  0.477442  1
  C  C100  1  0.033067  0.632348  0.508669  1
  C  C101  1  0.116382  0.965620  0.525003  1
  C  C102  1  0.949848  0.299432  0.491939  1
  C  C103  1  0.283194  0.632810  0.492046  1
  C  C104  1  0.366458  0.965924  0.508368  1
  C  C105  1  0.449692  0.299024  0.525379  1
  C  C106  1  0.711156  0.346852  0.510402  1
  C  C107  1  0.544629  0.680604  0.477066  1
  C  C108  1  0.627876  0.013707  0.494077  1
  C  C109  1  0.961276  0.347320  0.493777  1
  C  C110  1  0.044501  0.680181  0.510510  1
  C  C111  1  0.877951  0.014011  0.477442  1
  C  C112  1  0.533067  0.632345  0.508675  1
  C  C113  1  0.616382  0.965620  0.525003  1
  C  C114  1  0.449847  0.299431  0.491938  1
  C  C115  1  0.783167  0.632810  0.492046  1
  C  C116  1  0.866456  0.965924  0.508368  1
  C  C117  1  0.949692  0.299025  0.525380  1
  C  C118  1  0.211166  0.346852  0.510402  1
  C  C119  1  0.044632  0.680608  0.477070  1
  C  C120  1  0.127877  0.013707  0.494077  1
  C  C121  1  0.710978  0.346074  0.543857  1
  C  C122  1  0.794403  0.679975  0.560629  1
  C  C123  1  0.627725  0.013090  0.527541  1
  C  C124  1  0.282625  0.630580  0.558688  1
  C  C125  1  0.366153  0.964686  0.575075  1
  C  C126  1  0.199620  0.298732  0.542038  1
  C  C127  1  0.532792  0.631204  0.542104  1
  C  C128  1  0.616231  0.965003  0.558466  1
  C  C129  1  0.699430  0.297964  0.575474  1
  C  C130  1  0.960898  0.345759  0.560466  1
  C  C131  1  0.794458  0.680056  0.527173  1
  C  C132  1  0.877647  0.012773  0.544149  1
  C  C133  1  0.210974  0.346074  0.543857  1
  C  C134  1  0.294422  0.679975  0.560630  1
  C  C135  1  0.127725  0.013090  0.527541  1
  C  C136  1  0.782653  0.630580  0.558688  1
  C  C137  1  0.866153  0.964686  0.575075  1
  C  C138  1  0.699618  0.298732  0.542039  1
  C  C139  1  0.032794  0.631208  0.542099  1
  C  C140  1  0.116231  0.965003  0.558467  1
  C  C141  1  0.199430  0.297964  0.575474  1
  C  C142  1  0.460900  0.345760  0.560465  1
  C  C143  1  0.294479  0.680056  0.527172  1
  C  C144  1  0.377647  0.012773  0.544149  1
  C  C145  1  0.960777  0.345270  0.593994  1
  C  C146  1  0.044442  0.680109  0.610769  1
  C  C147  1  0.877484  0.012103  0.577670  1
  C  C148  1  0.532138  0.628541  0.608625  1
  C  C149  1  0.615903  0.963670  0.625090  1
  C  C150  1  0.449325  0.297536  0.592101  1
  C  C151  1  0.782309  0.629234  0.592158  1
  C  C152  1  0.865988  0.964016  0.608596  1
  C  C153  1  0.949094  0.296366  0.625553  1
  C  C154  1  0.210734  0.345085  0.610494  1
  C  C155  1  0.044414  0.679977  0.577269  1
  C  C156  1  0.127398  0.011757  0.594164  1
  C  C157  1  0.460780  0.345272  0.593993  1
  C  C158  1  0.544474  0.680221  0.610772  1
  C  C159  1  0.377482  0.012103  0.577670  1
  C  C160  1  0.032138  0.628536  0.608624  1
  C  C161  1  0.115904  0.963670  0.625090  1
  C  C162  1  0.949310  0.297468  0.592097  1
  C  C163  1  0.282310  0.629234  0.592158  1
  C  C164  1  0.365989  0.964016  0.608595  1
  C  C165  1  0.449108  0.296480  0.625562  1
  C  C166  1  0.710731  0.345085  0.610494  1
  C  C167  1  0.544423  0.680026  0.577272  1
  C  C168  1  0.627398  0.011757  0.594164  1
  C  C169  1  0.210658  0.344794  0.644227  1
  C  C170  1  0.294528  0.680456  0.660970  1
  C  C171  1  0.127215  0.011015  0.627880  1
  C  C172  1  0.781598  0.626364  0.658411  1
  C  C173  1  0.865631  0.962561  0.674964  1
  C  C174  1  0.698952  0.295826  0.642090  1
  C  C175  1  0.031770  0.627065  0.642281  1
  C  C176  1  0.115721  0.962928  0.658806  1
  C  C177  1  0.198680  0.294510  0.675670  1
  C  C178  1  0.460624  0.344677  0.660395  1
  C  C179  1  0.294474  0.680269  0.627330  1
  C  C180  1  0.377125  0.010648  0.644038  1
  C  C181  1  0.710649  0.344794  0.644227  1
  C  C182  1  0.794592  0.680452  0.660971  1
  C  C183  1  0.627215  0.011015  0.627880  1
  C  C184  1  0.281596  0.626364  0.658411  1
  C  C185  1  0.365630  0.962561  0.674964  1
  C  C186  1  0.198961  0.295828  0.642094  1
  C  C187  1  0.531772  0.627069  0.642281  1
  C  C188  1  0.615722  0.962928  0.658806  1
  C  C189  1  0.698655  0.294506  0.675666  1
  C  C190  1  0.960629  0.344689  0.660394  1
  C  C191  1  0.794493  0.680261  0.627332  1
  C  C192  1  0.877126  0.010648  0.644039  1
  C  C193  1  0.460572  0.344487  0.694771  1
  C  C194  1  0.541842  0.669264  0.708117  1
  C  C195  1  0.376929  0.009851  0.678393  1
  C  C196  1  0.031073  0.624259  0.706237  1
  C  C197  1  0.115359  0.961448  0.722870  1
  C  C198  1  0.949277  0.297037  0.691506  1
  C  C199  1  0.281211  0.624855  0.692706  1
  C  C200  1  0.365435  0.961764  0.709318  1
  C  C201  1  0.445430  0.281122  0.721380  1
  C  C202  1  0.710561  0.344421  0.708330  1
  C  C203  1  0.543797  0.677371  0.676558  1
  C  C204  1  0.626852  0.009535  0.691945  1
  C  C205  1  0.960578  0.344509  0.694769  1
  C  C206  1  0.047547  0.692258  0.707758  1
  C  C207  1  0.876929  0.009851  0.678393  1
  C  C208  1  0.531073  0.624251  0.706231  1
  C  C209  1  0.615356  0.961448  0.722870  1
  C  C210  1  0.447736  0.290705  0.690866  1
  C  C211  1  0.781230  0.624855  0.692706  1
  C  C212  1  0.865434  0.961764  0.709318  1
  C  C213  1  0.950845  0.303943  0.723766  1
  C  C214  1  0.210551  0.344421  0.708330  1
  C  C215  1  0.045367  0.683743  0.676467  1
  C  C216  1  0.126851  0.009535  0.691945  1
