# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   20.85237035
_cell_length_b   21.37427591
_cell_length_c   16.80424999
_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   7489.72676729
_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  0.149185  0.376424  0.547621  1
  C  C2  1  0.148673  0.874992  0.551776  1
  C  C3  1  0.649347  0.376494  0.548893  1
  C  C4  1  0.649614  0.876311  0.548960  1
  C  C5  1  0.399268  0.126445  0.950381  1
  C  C6  1  0.399268  0.626445  0.950381  1
  C  C7  1  0.899268  0.126445  0.950381  1
  C  C8  1  0.899268  0.626445  0.950381  1
  C  C9  1  0.207625  0.500180  0.550675  1
  C  C10  1  0.707105  0.000180  0.551930  1
  C  C11  1  0.707677  0.500180  0.551925  1
  C  C12  1  0.120724  0.211483  0.827941  1
  C  C13  1  0.120724  0.711483  0.827941  1
  C  C14  1  0.620724  0.211483  0.827941  1
  C  C15  1  0.620724  0.711483  0.827941  1
  C  C16  1  0.088287  0.332407  0.576365  1
  C  C17  1  0.084906  0.831276  0.578195  1
  C  C18  1  0.588478  0.332506  0.577712  1
  C  C19  1  0.588850  0.832273  0.577928  1
  C  C20  1  0.159927  0.417923  0.921521  1
  C  C21  1  0.159927  0.917923  0.921521  1
  C  C22  1  0.659927  0.417923  0.921521  1
  C  C23  1  0.659927  0.917923  0.921521  1
  C  C24  1  0.370585  0.461486  0.670755  1
  C  C25  1  0.372233  0.961783  0.673976  1
  C  C26  1  0.870954  0.461483  0.671159  1
  C  C27  1  0.868870  0.961476  0.672471  1
  C  C28  1  0.312546  0.327726  0.804016  1
  C  C29  1  0.312546  0.827726  0.804016  1
  C  C30  1  0.812546  0.327726  0.804016  1
  C  C31  1  0.812546  0.827726  0.804016  1
  C  C32  1  0.349094  0.376498  0.548245  1
  C  C33  1  0.350977  0.875145  0.548972  1
  C  C34  1  0.849051  0.376442  0.548759  1
  C  C35  1  0.847508  0.876196  0.549188  1
  C  C36  1  0.099086  0.126445  0.950381  1
  C  C37  1  0.099086  0.626445  0.950381  1
  C  C38  1  0.599086  0.126445  0.950381  1
  C  C39  1  0.599086  0.626445  0.950381  1
  C  C40  1  0.185808  0.172634  0.804016  1
  C  C41  1  0.185808  0.672634  0.804016  1
  C  C42  1  0.685808  0.172634  0.804016  1
  C  C43  1  0.685808  0.672634  0.804016  1
  C  C44  1  0.062789  0.422584  0.694214  1
  C  C45  1  0.060167  0.922894  0.695030  1
  C  C46  1  0.562444  0.422672  0.695183  1
  C  C47  1  0.563551  0.922403  0.696384  1
  C  C48  1  0.459597  0.361309  0.643444  1
  C  C49  1  0.460744  0.861076  0.644749  1
  C  C50  1  0.959792  0.361209  0.643241  1
  C  C51  1  0.957077  0.860885  0.644985  1
  C  C52  1  0.040741  0.250180  0.947414  1
  C  C53  1  0.040741  0.750180  0.947414  1
  C  C54  1  0.540741  0.250180  0.947414  1
  C  C55  1  0.540741  0.750180  0.947414  1
  C  C56  1  0.457613  0.250180  0.947414  1
  C  C57  1  0.457613  0.750180  0.947414  1
  C  C58  1  0.957613  0.250180  0.947414  1
  C  C59  1  0.957613  0.750180  0.947414  1
  C  C60  1  -0.000448  0.461746  0.725156  1
  C  C61  1  0.997409  0.961598  0.726264  1
  C  C62  1  0.499020  0.461747  0.725702  1
  C  C63  1  0.500423  0.961773  0.727060  1
  C  C64  1  0.084906  0.169084  0.578195  1
  C  C65  1  0.088287  0.667953  0.576365  1
  C  C66  1  0.588850  0.168088  0.577928  1
  C  C67  1  0.588478  0.667854  0.577712  1
  C  C68  1  0.120724  0.288877  0.827941  1
  C  C69  1  0.120724  0.788877  0.827941  1
  C  C70  1  0.620724  0.288877  0.827941  1
  C  C71  1  0.620724  0.788877  0.827941  1
  C  C72  1  0.060167  0.077466  0.695030  1
  C  C73  1  0.062789  0.577776  0.694214  1
  C  C74  1  0.563551  0.077957  0.696384  1
  C  C75  1  0.562444  0.577688  0.695183  1
  C  C76  1  0.350977  0.125216  0.548972  1
  C  C77  1  0.349094  0.623862  0.548245  1
  C  C78  1  0.847508  0.124165  0.549188  1
  C  C79  1  0.849051  0.623918  0.548759  1
  C  C80  1  0.304475  0.000180  0.547645  1
  C  C81  1  0.290753  0.500180  0.550985  1
  C  C82  1  0.790247  0.000180  0.552044  1
  C  C83  1  0.790803  0.500180  0.551864  1
  C  C84  1  0.435648  0.422704  0.694955  1
  C  C85  1  0.437017  0.922396  0.696660  1
  C  C86  1  0.936083  0.422631  0.694886  1
  C  C87  1  0.933684  0.922282  0.696522  1
  C  C88  1  0.172892  0.076679  0.614936  1
  C  C89  1  0.172132  0.561258  0.594837  1
  C  C90  1  0.672124  0.061360  0.596479  1
  C  C91  1  0.672162  0.561187  0.596202  1
  C  C92  1  0.426562  0.288899  0.499291  1
  C  C93  1  0.427800  0.788129  0.499522  1
  C  C94  1  0.925870  0.288466  0.499506  1
  C  C95  1  0.924899  0.788570  0.500010  1
  C  C96  1  0.312546  0.172634  0.804016  1
  C  C97  1  0.312546  0.672634  0.804016  1
  C  C98  1  0.812546  0.172634  0.804016  1
  C  C99  1  0.812546  0.672634  0.804016  1
  C  C100  1  0.070821  0.211599  0.499402  1
  C  C101  1  0.072258  0.711954  0.498430  1
  C  C102  1  0.572947  0.211886  0.499717  1
  C  C103  1  0.572582  0.711786  0.499603  1
  C  C104  1  0.036456  0.139080  0.644023  1
  C  C105  1  0.038862  0.639134  0.642623  1
  C  C106  1  0.539728  0.139314  0.644589  1
  C  C107  1  0.538677  0.639081  0.643539  1
  C  C108  1  0.185808  0.327726  0.804016  1
  C  C109  1  0.185808  0.827726  0.804016  1
  C  C110  1  0.685808  0.327726  0.804016  1
  C  C111  1  0.685808  0.827726  0.804016  1
  C  C112  1  0.437017  0.077964  0.696660  1
  C  C113  1  0.435648  0.577656  0.694955  1
  C  C114  1  0.933684  0.078079  0.696522  1
  C  C115  1  0.936083  0.577729  0.694886  1
  C  C116  1  0.076231  0.189151  0.903153  1
  C  C117  1  0.076231  0.689151  0.903153  1
  C  C118  1  0.576231  0.189151  0.903153  1
  C  C119  1  0.576231  0.689151  0.903153  1
  C  C120  1  0.422123  0.189151  0.903153  1
  C  C121  1  0.422123  0.689151  0.903153  1
  C  C122  1  0.922123  0.189151  0.903153  1
  C  C123  1  0.922123  0.689151  0.903153  1
  C  C124  1  0.172132  0.439103  0.594837  1
  C  C125  1  0.172892  0.923681  0.614936  1
  C  C126  1  0.672162  0.439174  0.596202  1
  C  C127  1  0.672124  0.939000  0.596479  1
  C  C128  1  0.377631  0.288877  0.827941  1
  C  C129  1  0.377631  0.788877  0.827941  1
  C  C130  1  0.877631  0.288877  0.827941  1
  C  C131  1  0.877631  0.788877  0.827941  1
  C  C132  1  0.127890  0.040423  0.673082  1
  C  C133  1  0.127817  0.538879  0.670183  1
  C  C134  1  0.628459  0.038885  0.672352  1
  C  C135  1  0.627571  0.538876  0.671338  1
  C  C136  1  0.076231  0.311210  0.903153  1
  C  C137  1  0.076231  0.811210  0.903153  1
  C  C138  1  0.576231  0.311210  0.903153  1
  C  C139  1  0.576231  0.811210  0.903153  1
  C  C140  1  0.159927  0.082437  0.921521  1
  C  C141  1  0.159927  0.582437  0.921521  1
  C  C142  1  0.659927  0.082437  0.921521  1
  C  C143  1  0.659927  0.582437  0.921521  1
  C  C144  1  0.338427  0.082437  0.921521  1
  C  C145  1  0.338427  0.582437  0.921521  1
  C  C146  1  0.838427  0.082437  0.921521  1
  C  C147  1  0.838427  0.582437  0.921521  1
  C  C148  1  0.209638  0.111234  0.855606  1
  C  C149  1  0.209638  0.611234  0.855606  1
  C  C150  1  0.709638  0.111234  0.855606  1
  C  C151  1  0.709638  0.611234  0.855606  1
  C  C152  1  0.072258  0.288406  0.498430  1
  C  C153  1  0.070821  0.788761  0.499402  1
  C  C154  1  0.572582  0.288575  0.499603  1
  C  C155  1  0.572947  0.788474  0.499717  1
  C  C156  1  0.399268  0.373915  0.950381  1
  C  C157  1  0.399268  0.873915  0.950381  1
  C  C158  1  0.899268  0.373915  0.950381  1
  C  C159  1  0.899268  0.873915  0.950381  1
  C  C160  1  0.038862  0.361226  0.642623  1
  C  C161  1  0.036456  0.861280  0.644023  1
  C  C162  1  0.538677  0.361279  0.643539  1
  C  C163  1  0.539728  0.861046  0.644589  1
  C  C164  1  0.377631  0.211483  0.827941  1
  C  C165  1  0.377631  0.711483  0.827941  1
  C  C166  1  0.877631  0.211483  0.827941  1
  C  C167  1  0.877631  0.711483  0.827941  1
  C  C168  1  0.422123  0.311210  0.903153  1
  C  C169  1  0.422123  0.811210  0.903153  1
  C  C170  1  0.922123  0.311210  0.903153  1
  C  C171  1  0.922123  0.811210  0.903153  1
  C  C172  1  0.326186  0.439204  0.595429  1
  C  C173  1  0.328996  0.938816  0.596406  1
  C  C174  1  0.826316  0.439145  0.596082  1
  C  C175  1  0.825187  0.938980  0.596607  1
  C  C176  1  0.338427  0.417923  0.921521  1
  C  C177  1  0.338427  0.917923  0.921521  1
  C  C178  1  0.838427  0.417923  0.921521  1
  C  C179  1  0.838427  0.917923  0.921521  1
  C  C180  1  0.411776  0.168488  0.578088  1
  C  C181  1  0.409964  0.667727  0.577357  1
  C  C182  1  0.908173  0.168326  0.578343  1
  C  C183  1  0.909867  0.667965  0.577590  1
  C  C184  1  0.288716  0.111234  0.855606  1
  C  C185  1  0.288716  0.611234  0.855606  1
  C  C186  1  0.788716  0.111234  0.855606  1
  C  C187  1  0.788716  0.611234  0.855606  1
  C  C188  1  0.328996  0.061544  0.596406  1
  C  C189  1  0.326186  0.561156  0.595429  1
  C  C190  1  0.825187  0.061380  0.596607  1
  C  C191  1  0.826316  0.561215  0.596082  1
  C  C192  1  0.288716  0.389126  0.855606  1
  C  C193  1  0.288716  0.889126  0.855606  1
  C  C194  1  0.788716  0.389126  0.855606  1
  C  C195  1  0.788716  0.889126  0.855606  1
  C  C196  1  0.372233  0.038577  0.673976  1
  C  C197  1  0.370585  0.538875  0.670755  1
  C  C198  1  0.868870  0.038884  0.672471  1
  C  C199  1  0.870954  0.538877  0.671159  1
  C  C200  1  0.460744  0.139284  0.644749  1
  C  C201  1  0.459597  0.639051  0.643444  1
  C  C202  1  0.957077  0.139475  0.644985  1
  C  C203  1  0.959792  0.639151  0.643241  1
  C  C204  1  0.997409  0.038762  0.726264  1
  C  C205  1  -0.000448  0.538614  0.725156  1
  C  C206  1  0.500423  0.038587  0.727060  1
  C  C207  1  0.499020  0.538613  0.725702  1
  C  C208  1  0.409964  0.332633  0.577357  1
  C  C209  1  0.411776  0.831873  0.578088  1
  C  C210  1  0.909867  0.332395  0.577590  1
  C  C211  1  0.908173  0.832034  0.578343  1
  C  C212  1  0.249177  0.288614  0.773403  1
  C  C213  1  0.249177  0.788614  0.773403  1
  C  C214  1  0.749177  0.288614  0.773403  1
  C  C215  1  0.749177  0.788614  0.773403  1
  C  C216  1  0.209638  0.389126  0.855606  1
  C  C217  1  0.209638  0.889126  0.855606  1
  C  C218  1  0.709638  0.389126  0.855606  1
  C  C219  1  0.709638  0.889126  0.855606  1
  C  C220  1  0.099086  0.373915  0.950381  1
  C  C221  1  0.099086  0.873915  0.950381  1
  C  C222  1  0.599086  0.373915  0.950381  1
  C  C223  1  0.599086  0.873915  0.950381  1
  C  C224  1  0.427800  0.212231  0.499522  1
  C  C225  1  0.426562  0.711462  0.499291  1
  C  C226  1  0.924899  0.211790  0.500010  1
  C  C227  1  0.925870  0.711894  0.499506  1
  C  C228  1  0.127817  0.461482  0.670183  1
  C  C229  1  0.127890  0.959938  0.673082  1
  C  C230  1  0.627571  0.461485  0.671338  1
  C  C231  1  0.628459  0.961475  0.672352  1
  C  C232  1  0.148673  0.125368  0.551776  1
  C  C233  1  0.149185  0.623937  0.547621  1
  C  C234  1  0.649614  0.124050  0.548960  1
  C  C235  1  0.649347  0.623866  0.548893  1
  C  C236  1  0.249177  0.211746  0.773403  1
  C  C237  1  0.249177  0.711746  0.773403  1
  C  C238  1  0.749177  0.211746  0.773403  1
  C  C239  1  0.749177  0.711746  0.773403  1
  C  C240  1  0.399268  0.126445  0.048785  1
  C  C241  1  0.399268  0.626445  0.048785  1
  C  C242  1  0.899268  0.126445  0.048785  1
  C  C243  1  0.899268  0.626445  0.048785  1
  C  C244  1  0.149357  0.376341  0.449241  1
  C  C245  1  0.146689  0.879124  0.452278  1
  C  C246  1  0.649407  0.376479  0.450487  1
  C  C247  1  0.649734  0.876291  0.450543  1
  C  C248  1  0.457613  0.250180  0.051752  1
  C  C249  1  0.457613  0.750180  0.051752  1
  C  C250  1  0.957613  0.250180  0.051752  1
  C  C251  1  0.957613  0.750180  0.051752  1
  C  C252  1  0.371008  0.461484  0.327396  1
  C  C253  1  0.371965  0.961224  0.328370  1
  C  C254  1  0.870615  0.461482  0.327831  1
  C  C255  1  0.868952  0.961473  0.327430  1
  C  C256  1  0.338427  0.082437  0.077645  1
  C  C257  1  0.338427  0.582437  0.077645  1
  C  C258  1  0.838427  0.082437  0.077645  1
  C  C259  1  0.838427  0.582437  0.077645  1
  C  C260  1  0.411901  0.168503  0.421514  1
  C  C261  1  0.410165  0.667788  0.421099  1
  C  C262  1  0.908802  0.167905  0.421965  1
  C  C263  1  0.909984  0.667899  0.421449  1
  C  C264  1  0.120724  0.211483  0.171225  1
  C  C265  1  0.120724  0.711483  0.171225  1
  C  C266  1  0.620724  0.211483  0.171225  1
  C  C267  1  0.620724  0.711483  0.171225  1
  C  C268  1  0.060190  0.077830  0.302355  1
  C  C269  1  0.062386  0.577743  0.303327  1
  C  C270  1  0.563501  0.077973  0.303235  1
  C  C271  1  0.562879  0.577730  0.303829  1
  C  C272  1  0.099086  0.126445  0.048785  1
  C  C273  1  0.099086  0.626445  0.048785  1
  C  C274  1  0.599086  0.126445  0.048785  1
  C  C275  1  0.599086  0.626445  0.048785  1
  C  C276  1  0.349218  0.376483  0.449838  1
  C  C277  1  0.350743  0.875902  0.450635  1
  C  C278  1  0.849145  0.376453  0.450352  1
  C  C279  1  0.847835  0.876299  0.450791  1
  C  C280  1  0.436130  0.422666  0.303542  1
  C  C281  1  0.437034  0.922388  0.303665  1
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