# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   19.96556389
_cell_length_b   23.64732059
_cell_length_c   49.92320567
_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   C560
_cell_volume   23570.3474321
_cell_formula_units_Z   560
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  0.598754  -0.000762  0.346336  1
  C  C2  1  0.551258  0.209780  0.483728  1
  C  C3  1  0.720334  0.188166  0.392110  1
  C  C4  1  0.214303  0.750563  0.390989  1
  C  C5  1  0.577796  0.880946  0.436049  1
  C  C6  1  0.835354  0.721425  0.317400  1
  C  C7  1  0.600427  0.680295  0.503216  1
  C  C8  1  0.571463  0.567100  0.302124  1
  C  C9  1  0.637911  0.516244  0.469518  1
  C  C10  1  0.191563  0.055216  0.436855  1
  C  C11  1  0.697079  0.610700  0.322936  1
  C  C12  1  0.553744  0.107436  0.455470  1
  C  C13  1  0.332613  0.465056  0.309450  1
  C  C14  1  0.620539  0.599820  0.326420  1
  C  C15  1  0.283518  0.423474  0.291241  1
  C  C16  1  0.715553  0.505888  0.478997  1
  C  C17  1  0.546301  0.211519  0.426386  1
  C  C18  1  0.447415  0.776956  0.373829  1
  C  C19  1  0.678807  0.397315  0.498429  1
  C  C20  1  0.344791  -0.000950  0.484482  1
  C  C21  1  0.602910  0.941231  0.423841  1
  C  C22  1  0.439217  0.845385  0.375599  1
  C  C23  1  0.837621  0.216388  0.421296  1
  C  C24  1  0.456476  0.051316  0.499727  1
  C  C25  1  0.553238  0.244936  0.455127  1
  C  C26  1  0.427172  0.639089  0.316605  1
  C  C27  1  0.300465  -0.005146  0.298437  1
  C  C28  1  0.517082  0.654071  0.361235  1
  C  C29  1  0.542322  0.140672  0.484022  1
  C  C30  1  0.249314  0.789483  0.414380  1
  C  C31  1  0.245432  0.345137  0.460396  1
  C  C32  1  0.247006  0.687605  0.386230  1
  C  C33  1  0.222863  0.533969  0.315027  1
  C  C34  1  0.387362  0.038587  0.384995  1
  C  C35  1  0.508863  0.851427  0.424124  1
  C  C36  1  0.230074  0.505940  0.442981  1
  C  C37  1  0.460735  0.324515  0.289587  1
  C  C38  1  0.186773  0.260585  0.493593  1
  C  C39  1  0.439542  0.745981  0.343868  1
  C  C40  1  0.524571  0.100472  0.403882  1
  C  C41  1  0.689364  0.986107  0.389739  1
  C  C42  1  0.511202  0.035686  0.416148  1
  C  C43  1  0.348310  0.352464  0.421199  1
  C  C44  1  0.842570  0.820991  0.345827  1
  C  C45  1  0.733524  0.971238  0.335264  1
  C  C46  1  0.399626  0.372660  0.294297  1
  C  C47  1  0.380002  0.369454  0.476399  1
  C  C48  1  0.473206  0.454498  0.327169  1
  C  C49  1  0.317606  0.258108  0.254643  1
  C  C50  1  0.461483  0.469256  0.504869  1
  C  C51  1  0.682824  0.949305  0.418129  1
  C  C52  1  0.317636  0.657741  0.464968  1
  C  C53  1  0.429244  0.349968  0.501916  1
  C  C54  1  0.476789  0.946003  0.356824  1
  C  C55  1  0.661351  -0.007097  0.327589  1
  C  C56  1  0.178624  0.260982  0.436864  1
  C  C57  1  0.557932  0.980516  0.402258  1
  C  C58  1  0.437454  0.002401  0.405779  1
  C  C59  1  0.602785  0.578170  0.475010  1
  C  C60  1  0.162224  0.192906  0.436454  1
  C  C61  1  0.308466  0.027950  0.392422  1
  C  C62  1  0.803163  0.922142  0.374956  1
  C  C63  1  0.586841  0.619233  0.355156  1
  C  C64  1  0.387055  0.209116  0.370767  1
  C  C65  1  0.228573  0.289483  0.414380  1
  C  C66  1  0.180903  0.159083  0.408697  1
  C  C67  1  0.581331  0.466470  0.474530  1
  C  C68  1  0.402916  0.366615  0.445096  1
  C  C69  1  0.286324  0.555216  0.436855  1
  C  C70  1  0.467688  0.883766  0.400361  1
  C  C71  1  0.297294  0.520371  0.320490  1
  C  C72  1  0.426219  0.787977  0.319245  1
  C  C73  1  0.247813  0.005940  0.442981  1
  C  C74  1  0.197535  0.818701  0.265070  1
  C  C75  1  0.644810  0.630774  0.488438  1
  C  C76  1  0.821026  0.890208  0.345470  1
  C  C77  1  0.160281  0.758108  0.254643  1
  C  C78  1  0.267137  0.009446  0.475032  1
  C  C79  1  0.300811  0.589734  0.464929  1
  C  C80  1  0.210750  0.509446  0.475032  1
  C  C81  1  0.310467  0.886287  0.268553  1
  C  C82  1  0.519062  0.986527  0.337377  1
  C  C83  1  0.160251  0.157741  0.464968  1
  C  C84  1  0.473883  0.334639  0.437124  1
  C  C85  1  0.269498  0.341697  0.428861  1
  C  C86  1  0.263584  0.250563  0.390989  1
  C  C87  1  0.384764  0.982162  0.430096  1
  C  C88  1  0.177422  0.494854  0.298437  1
  C  C89  1  0.555649  0.142467  0.426848  1
  C  C90  1  0.750075  0.971970  0.368967  1
  C  C91  1  0.523816  0.567094  0.482843  1
  C  C92  1  0.409191  0.097741  0.370731  1
  C  C93  1  0.488281  0.744866  0.397954  1
  C  C94  1  0.133096  0.499050  0.484482  1
  C  C95  1  0.274210  0.833456  0.259648  1
  C  C96  1  0.384641  0.311198  0.398957  1
  C  C97  1  0.504521  0.316447  0.493483  1
  C  C98  1  0.600972  0.407070  0.489101  1
  C  C99  1  0.736363  0.445760  0.493466  1
  C  C100  1  0.177076  0.089734  0.464929  1
  C  C101  1  0.301033  0.358697  0.483748  1
  C  C102  1  0.483687  0.949773  0.390275  1
  C  C103  1  0.472339  0.017293  0.471612  1
  C  C104  1  0.306905  -0.007439  0.421013  1
  C  C105  1  0.519553  0.306938  0.460806  1
  C  C106  1  0.193351  0.090213  0.408482  1
  C  C107  1  0.251481  0.076147  0.386043  1
  C  C108  1  0.405999  0.430749  0.310811  1
  C  C109  1  0.613429  -0.001253  0.379335  1
  C  C110  1  0.230881  0.187605  0.386230  1
  C  C111  1  0.462376  0.300563  0.408675  1
  C  C112  1  0.757143  0.225863  0.415677  1
  C  C113  1  0.194369  0.923474  0.291241  1
  C  C114  1  0.485123  0.608793  0.504128  1
  C  C115  1  0.488107  0.014609  0.309317  1
  C  C116  1  0.464760  0.198227  0.380480  1
  C  C117  1  0.524876  0.684375  0.391004  1
  C  C118  1  0.274187  0.136341  0.372101  1
  C  C119  1  0.510344  0.498291  0.482608  1
  C  C120  1  0.520563  0.782576  0.422512  1
  C  C121  1  0.254066  0.561447  0.488543  1
  C  C122  1  0.275663  0.936840  0.285384  1
  C  C123  1  0.303193  0.691675  0.493097  1
  C  C124  1  0.202224  0.436840  0.285384  1
  C  C125  1  0.427924  0.851898  0.320734  1
  C  C126  1  0.478791  0.129526  0.380577  1
  C  C127  1  0.402870  0.985143  0.461884  1
  C  C128  1  0.154884  0.866846  0.282075  1
  C  C129  1  0.852140  0.784045  0.319534  1
  C  C130  1  0.499961  0.240091  0.402648  1
  C  C131  1  0.342757  0.261504  0.383176  1
  C  C132  1  0.323003  0.366846  0.282075  1
  C  C133  1  0.174694  0.191675  0.493097  1
  C  C134  1  0.352971  0.147161  0.364409  1
  C  C135  1  0.521371  0.045200  0.449064  1
  C  C136  1  0.723194  0.287371  0.422512  1
  C  C137  1  0.188744  0.295571  0.465221  1
  C  C138  1  0.440719  0.885547  0.348012  1
  C  C139  1  0.461438  0.679062  0.340592  1
  C  C140  1  0.291114  0.760585  0.493593  1
  C  C141  1  0.074971  0.866615  0.445096  1
  C  C142  1  0.038670  0.345385  0.375599  1
  C  C143  1  0.223821  0.061447  0.488543  1
  C  C144  1  0.722793  0.620208  0.498068  1
  C  C145  1  0.145273  0.965056  0.309450  1
  C  C146  1  0.284536  0.590213  0.408482  1
  C  C147  1  0.093246  0.811198  0.398957  1
  C  C148  1  0.040433  0.502401  0.405779  1
  C  C149  1  0.124916  0.647161  0.364409  1
  C  C150  1  0.670507  0.185690  0.341897  1
  C  C151  1  0.170982  0.492561  0.421013  1
  C  C152  1  0.038345  0.245981  0.343868  1
  C  C153  1  0.900091  0.380946  0.436049  1
  C  C154  1  0.093123  0.482162  0.430096  1
  C  C155  1  0.846783  0.329249  0.442351  1
  C  C156  1  0.203700  0.636341  0.372101  1
  C  C157  1  0.049963  0.351898  0.320734  1
  C  C158  1  0.935565  0.640672  0.484022  1
  C  C159  1  0.169421  0.527950  0.392422  1
  C  C160  1  0.840385  0.129900  0.380651  1
  C  C161  1  0.180593  0.020371  0.320490  1
  C  C162  1  0.926629  0.709780  0.483728  1
  C  C163  1  0.280352  0.318701  0.265070  1
  C  C164  1  0.953011  0.184375  0.391004  1
  C  C165  1  0.037168  0.385547  0.348012  1
  C  C166  1  0.966684  0.535686  0.416148  1
  C  C167  1  0.737386  0.899334  0.424380  1
  C  C168  1  0.005548  0.517293  0.471612  1
  C  C169  1  0.030472  0.276956  0.373829  1
  C  C170  1  0.783544  0.925034  0.323741  1
  C  C171  1  0.727812  0.471970  0.368967  1
  C  C172  1  0.756443  0.557365  0.494072  1
  C  C173  1  0.795063  0.449305  0.418129  1
  C  C174  1  0.876914  0.907070  0.489101  1
  C  C175  1  0.071888  0.930749  0.310811  1
  C  C176  1  0.746813  0.635650  0.344161  1
  C  C177  1  -0.010394  0.244866  0.397954  1
  C  C178  1  0.680204  0.385646  0.402721  1
  C  C179  1  0.924143  0.607436  0.455470  1
  C  C180  1  0.016404  0.969256  0.504869  1
  C  C181  1  0.176854  0.858697  0.483748  1
  C  C182  1  0.050715  0.139089  0.316605  1
  C  C183  1  0.816536  0.492903  0.327589  1
  C  C184  1  0.315663  0.692906  0.436454  1
  C  C185  1  0.208389  0.841697  0.428861  1
  C  C186  1  0.957324  0.282576  0.422512  1
  C  C187  1  0.864458  0.498747  0.379335  1
  C  C188  1  0.010199  0.383766  0.400361  1
  C  C189  1  0.878638  0.169994  0.403085  1
  C  C190  1  0.953316  0.600472  0.403882  1
  C  C191  1  0.255024  0.033969  0.315027  1
  C  C192  1  0.830360  0.784685  0.373834  1
  C  C193  1  0.919955  0.480516  0.402258  1
  C  C194  1  0.958334  0.806938  0.460806  1
  C  C195  1  0.129577  0.852464  0.421199  1
  C  C196  1  0.656861  0.390208  0.345470  1
  C  C197  1  0.048643  0.849968  0.501916  1
  C  C198  1  0.906424  0.067100  0.302124  1
  C  C199  1  0.090832  0.709116  0.370767  1
  C  C200  1  0.635317  0.320991  0.345827  1
  C  C201  1  0.799080  0.897315  0.498429  1
  C  C202  1  0.289143  0.795571  0.465221  1
  C  C203  1  0.075017  0.485143  0.461884  1
  C  C204  1  0.875102  0.078170  0.475010  1
  C  C205  1  0.694343  0.425034  0.323741  1
  C  C206  1  0.625747  0.284045  0.319534  1
  C  C207  1  0.068696  0.597741  0.370731  1
  C  C208  1  0.879133  0.499238  0.346336  1
  C  C209  1  0.807380  0.685690  0.341897  1
  C  C210  1  0.004681  0.954498  0.327169  1
  C  C211  1  0.874977  0.441231  0.423841  1
  C  C212  1  0.922238  0.642467  0.426848  1
  C  C213  1  0.731074  0.135650  0.344161  1
  C  C214  1  0.640266  0.716388  0.421296  1
  C  C215  1  0.135130  0.761504  0.383176  1
  C  C216  1  0.299263  0.760982  0.436864  1
  C  C217  1  0.599249  0.669994  0.403085  1
  C  C218  1  0.760306  0.138871  0.375522  1
  C  C219  1  0.811446  0.717537  0.371390  1
  C  C220  1  0.717581  0.638871  0.375522  1
  C  C221  1  0.754693  0.787371  0.422512  1
  C  C222  1  0.004004  0.834639  0.437124  1
  C  C223  1  0.647527  0.284685  0.373834  1
  C  C224  1  0.958825  0.486527  0.337377  1
  C  C225  1  0.744363  0.471238  0.335264  1
  C  C226  1  0.755094  0.120208  0.498068  1
  C  C227  1  0.857348  0.099820  0.326420  1
  C  C228  1  0.740501  0.399334  0.424380  1
  C  C229  1  0.051668  0.287977  0.319245  1
  C  C230  1  0.232455  0.845137  0.460396  1
  C  C231  1  0.013127  0.698227  0.380480  1
  C  C232  1  0.896556  0.966470  0.474530  1
  C  C233  1  0.017152  0.824515  0.289587  1
  C  C234  1  0.637502  0.629900  0.380651  1
  C  C235  1  0.720744  0.725863  0.415677  1
  C  C236  1  0.877460  0.180295  0.503216  1
  C  C237  1  -0.005800  0.449773  0.390275  1
  C  C238  1  0.090524  0.538587  0.384995  1
  C  C239  1  0.226406  0.576147  0.386043  1
  C  C240  1  0.666441  0.217537  0.371390  1
  C  C241  1  0.788523  0.486107  0.389739  1
  C  C242  1  0.973366  0.816447  0.493483  1
  C  C243  1  0.960805  0.154071  0.361235  1
  C  C244  1  0.780808  0.110700  0.322936  1
  C  C245  1  0.001098  0.446003  0.356824  1
  C  C246  1  0.642533  0.221425  0.317400  1
  C  C247  1  0.741523  0.945760  0.493466  1
  C  C248  1  0.969024  0.351427  0.424124  1
  C  C249  1  0.097885  0.869454  0.476399  1
  C  C250  1  0.721444  0.057365  0.494072  1
  C  C251  1  -0.010220  0.514609  0.309317  1
  C  C252  1  0.203677  0.333456  0.259648  1
  C  C253  1  0.631104  0.829249  0.442351  1
  C  C254  1  0.977926  0.740091  0.402648  1
  C  C255  1  0.015511  0.800563  0.408675  1
  C  C256  1  0.954071  0.067094  0.482843  1
  C  C257  1  0.021411  0.551316  0.499727  1
  C  C258  1  0.762334  0.005888  0.478997  1
  C  C259  1  -0.000904  0.629526  0.380577  1
  C  C260  1  0.078261  0.872660  0.294297  1
  C  C261  1  0.757553  0.688166  0.392110  1
  C  C262  1  0.711183  0.838509  0.436657  1
  C  C263  1  0.808500  0.816586  0.401669  1
  C  C264  1  0.766704  0.338509  0.436657  1
  C  C265  1  0.931586  0.711519  0.426386  1
  C  C266  1  0.967543  -0.001709  0.482608  1
  C  C267  1  0.891046  0.119233  0.355156  1
  C  C268  1  0.596111  0.768796  0.433848  1
  C  C269  1  0.296984  0.659083  0.408697  1
  C  C270  1  -0.007236  0.108793  0.504128  1
  C  C271  1  0.833077  0.130774  0.488438  1
  C  C272  1  0.881776  0.268796  0.433848  1
  C  C273  1  0.669387  0.316586  0.401669  1
  C  C274  1  0.839976  0.016244  0.469518  1
  C  C275  1  0.016449  0.179062  0.340592  1
  C  C276  1  0.167420  0.386287  0.268553  1
  C  C277  1  0.674724  0.422142  0.374956  1
  C  C278  1  0.924649  0.744936  0.455127  1
  C  C279  1  0.956516  0.545200  0.449064  1
  C  C280  1  0.797682  0.885646  0.402721  1
  C  C281  1  0.575017  0.735585  0.548893  1
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