# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   23.30850625
_cell_length_b   19.49244960
_cell_length_c   20.19235057
_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   C559
_cell_volume   9174.19019882
_cell_formula_units_Z   559
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  0.393278  0.590932  0.432520  1
  C  C2  1  0.887723  0.593426  0.429973  1
  C  C3  1  0.036211  0.562358  0.816925  1
  C  C4  1  0.534620  0.561947  0.819613  1
  C  C5  1  0.377665  0.727188  0.678362  1
  C  C6  1  0.877665  0.727188  0.678362  1
  C  C7  1  0.099792  0.240475  0.247461  1
  C  C8  1  0.599792  0.240475  0.247461  1
  C  C9  1  0.113793  0.593426  0.429973  1
  C  C10  1  0.619797  0.594726  0.424286  1
  C  C11  1  0.460377  0.811524  0.109196  1
  C  C12  1  0.965561  0.811382  0.108210  1
  C  C13  1  0.333398  0.613007  0.321389  1
  C  C14  1  0.831100  0.615781  0.316704  1
  C  C15  1  0.000758  0.562196  0.011311  1
  C  C16  1  0.496254  0.563185  0.011743  1
  C  C17  1  0.348498  0.649392  0.112482  1
  C  C18  1  0.851872  0.651129  0.108141  1
  C  C19  1  0.035955  0.190240  0.608210  1
  C  C20  1  0.537821  0.188972  0.610371  1
  C  C21  1  0.036242  0.694790  0.023149  1
  C  C22  1  0.530139  0.696689  0.021568  1
  C  C23  1  0.036211  0.562358  0.677998  1
  C  C24  1  0.532942  0.561602  0.680824  1
  C  C25  1  0.113793  0.408196  0.929973  1
  C  C26  1  0.610094  0.406165  0.934501  1
  C  C27  1  0.056903  0.614437  0.022637  1
  C  C28  1  0.551862  0.616763  0.020843  1
  C  C29  1  0.149644  0.350492  0.886782  1
  C  C30  1  0.646237  0.348051  0.892249  1
  C  C31  1  0.368857  0.729888  0.112064  1
  C  C32  1  0.873119  0.731296  0.108195  1
  C  C33  1  0.428146  0.560868  0.748142  1
  C  C34  1  0.929362  0.553014  0.747461  1
  C  C35  1  0.072154  0.448608  0.247461  1
  C  C36  1  0.575096  0.449306  0.243063  1
  C  C37  1  0.459200  0.695130  0.023907  1
  C  C38  1  0.965274  0.694790  0.023149  1
  C  C39  1  0.149644  0.350492  0.608141  1
  C  C40  1  0.652972  0.347420  0.613657  1
  C  C41  1  0.056903  0.614437  0.472286  1
  C  C42  1  0.564084  0.615697  0.468224  1
  C  C43  1  0.036211  0.439264  0.316925  1
  C  C44  1  0.540549  0.438430  0.313152  1
  C  C45  1  0.423350  0.841668  0.747461  1
  C  C46  1  0.923350  0.841668  0.747461  1
  C  C47  1  0.148624  0.466125  0.678100  1
  C  C48  1  0.648588  0.462848  0.683845  1
  C  C49  1  0.464212  0.566053  0.820167  1
  C  C50  1  0.965304  0.562358  0.816925  1
  C  C51  1  0.000758  0.485862  0.056993  1
  C  C52  1  0.497666  0.486579  0.056863  1
  C  C53  1  0.321335  0.253508  0.429890  1
  C  C54  1  0.821335  0.253508  0.429890  1
  C  C55  1  0.113654  0.521464  0.108407  1
  C  C56  1  0.611965  0.524109  0.103407  1
  C  C57  1  0.072154  0.553014  0.747461  1
  C  C58  1  0.570349  0.549994  0.750706  1
  C  C59  1  0.123851  0.274434  0.316561  1
  C  C60  1  0.623851  0.274434  0.316561  1
  C  C61  1  0.424858  0.248776  0.928654  1
  C  C62  1  0.930180  0.248113  0.929890  1
  C  C63  1  0.123851  0.274434  0.178362  1
  C  C64  1  0.623851  0.274434  0.178362  1
  C  C65  1  0.036242  0.306832  0.971774  1
  C  C66  1  0.530322  0.305645  0.973768  1
  C  C67  1  0.451676  0.388312  0.523617  1
  C  C68  1  0.944613  0.387185  0.522637  1
  C  C69  1  0.113654  0.521464  0.386516  1
  C  C70  1  0.619022  0.522878  0.380661  1
  C  C71  1  0.321335  0.253508  0.065033  1
  C  C72  1  0.821335  0.253508  0.065033  1
  C  C73  1  0.129739  0.503940  0.747461  1
  C  C74  1  0.627440  0.501380  0.752359  1
  C  C75  1  0.035955  0.190240  0.886713  1
  C  C76  1  0.531088  0.189195  0.888831  1
  C  C77  1  0.036211  0.439264  0.177998  1
  C  C78  1  0.536856  0.439559  0.175266  1
  C  C79  1  0.944875  0.528610  0.607560  1
  C  C80  1  0.470614  0.693323  0.472161  1
  C  C81  1  0.965274  0.694790  0.471774  1
  C  C82  1  0.000758  0.515760  0.556993  1
  C  C83  1  0.515862  0.512899  0.547706  1
  C  C84  1  0.348709  0.352306  0.882847  1
  C  C85  1  0.851872  0.350492  0.886782  1
  C  C86  1  0.463442  0.840632  0.248467  1
  C  C87  1  0.965382  0.840983  0.247461  1
  C  C88  1  0.376058  0.728804  0.390359  1
  C  C89  1  0.873119  0.731296  0.386728  1
  C  C90  1  0.148624  0.466125  0.816823  1
  C  C91  1  0.646511  0.463605  0.821939  1
  C  C92  1  0.439569  0.387755  0.971596  1
  C  C93  1  0.944613  0.387185  0.972286  1
  C  C94  1  0.056640  0.528610  0.887362  1
  C  C95  1  0.554243  0.527031  0.890368  1
  C  C96  1  0.170415  0.385841  0.678218  1
  C  C97  1  0.671467  0.382942  0.684428  1
  C  C98  1  0.442821  0.472210  0.108503  1
  C  C99  1  0.944875  0.473012  0.107560  1
  C  C100  1  0.036242  0.694790  0.471774  1
  C  C101  1  0.541748  0.695010  0.469407  1
  C  C102  1  0.286133  0.340983  0.247461  1
  C  C103  1  0.786133  0.340983  0.247461  1
  C  C104  1  0.000758  0.439426  0.983612  1
  C  C105  1  0.496162  0.439002  0.984099  1
  C  C106  1  0.450376  0.471190  0.386437  1
  C  C107  1  0.944875  0.473012  0.387362  1
  C  C108  1  0.355640  0.648368  0.390756  1
  C  C109  1  0.851872  0.651129  0.386782  1
  C  C110  1  0.427770  0.177969  0.815554  1
  C  C111  1  0.931019  0.177637  0.816578  1
  C  C112  1  0.000758  0.562196  0.483612  1
  C  C113  1  0.508375  0.561521  0.480414  1
  C  C114  1  0.000758  0.439426  0.511311  1
  C  C115  1  0.509164  0.437512  0.508329  1
  C  C116  1  0.329773  0.613472  0.183042  1
  C  C117  1  0.831100  0.615781  0.178218  1
  C  C118  1  0.463569  0.160503  0.747535  1
  C  C119  1  0.965382  0.160639  0.747461  1
  C  C120  1  0.470622  0.308248  0.524504  1
  C  C121  1  0.965274  0.306832  0.523149  1
  C  C122  1  0.467570  0.810364  0.387500  1
  C  C123  1  0.965561  0.811382  0.386713  1
  C  C124  1  0.113793  0.593426  0.064950  1
  C  C125  1  0.610379  0.596284  0.060319  1
  C  C126  1  0.333893  0.387155  0.674485  1
  C  C127  1  0.831100  0.385841  0.678218  1
  C  C128  1  0.371003  0.228220  0.813823  1
  C  C129  1  0.873851  0.227188  0.816561  1
  C  C130  1  0.431046  0.177939  0.677338  1
  C  C131  1  0.931019  0.177637  0.678345  1
  C  C132  1  0.383868  0.592322  0.067978  1
  C  C133  1  0.887723  0.593426  0.064950  1
  C  C134  1  0.383904  0.409717  0.927477  1
  C  C135  1  0.887723  0.408196  0.929973  1
  C  C136  1  0.285955  0.311382  0.108210  1
  C  C137  1  0.785955  0.311382  0.108210  1
  C  C138  1  0.056640  0.473012  0.387362  1
  C  C139  1  0.562808  0.472714  0.383012  1
  C  C140  1  0.056903  0.387185  0.972286  1
  C  C141  1  0.551884  0.385631  0.974489  1
  C  C142  1  0.465990  0.437973  0.177559  1
  C  C143  1  0.965304  0.439264  0.177998  1
  C  C144  1  0.071335  0.248113  0.565033  1
  C  C145  1  0.574967  0.245862  0.568041  1
  C  C146  1  0.423350  0.159953  0.247461  1
  C  C147  1  0.923350  0.159953  0.247461  1
  C  C148  1  0.328176  0.657413  0.252471  1
  C  C149  1  0.828165  0.659953  0.247461  1
  C  C150  1  0.431073  0.822740  0.318647  1
  C  C151  1  0.931019  0.823985  0.316578  1
  C  C152  1  0.420415  0.115781  0.178218  1
  C  C153  1  0.920415  0.115781  0.178218  1
  C  C154  1  0.128396  0.270326  0.608195  1
  C  C155  1  0.631049  0.267567  0.613148  1
  C  C156  1  0.320496  0.323985  0.178345  1
  C  C157  1  0.820496  0.323985  0.178345  1
  C  C158  1  0.378396  0.231296  0.108195  1
  C  C159  1  0.878396  0.231296  0.108195  1
  C  C160  1  0.377665  0.274434  0.316561  1
  C  C161  1  0.877665  0.274434  0.316561  1
  C  C162  1  0.392925  0.519314  0.388557  1
  C  C163  1  0.887862  0.521464  0.386516  1
  C  C164  1  0.036133  0.160639  0.747461  1
  C  C165  1  0.534292  0.159538  0.749659  1
  C  C166  1  0.385001  0.481577  0.884475  1
  C  C167  1  0.887862  0.480158  0.886516  1
  C  C168  1  0.369092  0.271773  0.883737  1
  C  C169  1  0.873119  0.270326  0.886728  1
  C  C170  1  0.348946  0.262236  0.743960  1
  C  C171  1  0.849792  0.261147  0.747461  1
  C  C172  1  0.056903  0.387185  0.522637  1
  C  C173  1  0.565241  0.383480  0.521345  1
  C  C174  1  0.071335  0.248113  0.929890  1
  C  C175  1  0.566040  0.246586  0.933047  1
  C  C176  1  0.467870  0.579871  0.687930  1
  C  C177  1  0.965304  0.562358  0.677998  1
  C  C178  1  0.433976  0.751763  0.431584  1
  C  C179  1  0.930180  0.753508  0.429890  1
  C  C180  1  0.352240  0.533436  0.181945  1
  C  C181  1  0.852891  0.535497  0.178100  1
  C  C182  1  0.393374  0.413098  0.563874  1
  C  C183  1  0.887723  0.408196  0.564950  1
  C  C184  1  0.129739  0.497682  0.247461  1
  C  C185  1  0.631847  0.499767  0.241360  1
  C  C186  1  0.399644  0.151129  0.108141  1
  C  C187  1  0.899644  0.151129  0.108141  1
  C  C188  1  0.401723  0.240475  0.247461  1
  C  C189  1  0.901723  0.240475  0.247461  1
  C  C190  1  0.330200  0.387995  0.812413  1
  C  C191  1  0.831100  0.385841  0.816704  1
  C  C192  1  0.000758  0.515760  0.937930  1
  C  C193  1  0.497353  0.515554  0.939179  1
  C  C194  1  0.439592  0.614413  0.024155  1
  C  C195  1  0.944613  0.614437  0.022637  1
  C  C196  1  0.424543  0.753205  0.067089  1
  C  C197  1  0.930180  0.753508  0.065033  1
  C  C198  1  0.070496  0.177637  0.678345  1
  C  C199  1  0.570457  0.175982  0.681645  1
  C  C200  1  0.459373  0.307131  0.971667  1
  C  C201  1  0.965274  0.306832  0.971774  1
  C  C202  1  0.000758  0.485862  0.437930  1
  C  C203  1  0.507584  0.484388  0.433389  1
  C  C204  1  0.113654  0.480158  0.608407  1
  C  C205  1  0.614843  0.476138  0.613683  1
  C  C206  1  0.036242  0.306832  0.523149  1
  C  C207  1  0.541999  0.304798  0.524125  1
  C  C208  1  0.441639  0.530688  0.888023  1
  C  C209  1  0.944875  0.528610  0.887362  1
  C  C210  1  0.467417  0.190424  0.608342  1
  C  C211  1  0.965561  0.190240  0.608210  1
  C  C212  1  0.433995  0.249224  0.564536  1
  C  C213  1  0.930180  0.248113  0.565033  1
  C  C214  1  0.113654  0.480158  0.886516  1
  C  C215  1  0.610972  0.478255  0.891051  1
  C  C216  1  0.450411  0.613170  0.473379  1
  C  C217  1  0.944613  0.614437  0.472286  1
  C  C218  1  0.374360  0.228130  0.675789  1
  C  C219  1  0.873851  0.227188  0.678362  1
  C  C220  1  0.352721  0.468453  0.812475  1
  C  C221  1  0.852891  0.466125  0.816823  1
  C  C222  1  0.401723  0.761147  0.747461  1
  C  C223  1  0.901723  0.761147  0.747461  1
  C  C224  1  0.399644  0.151129  0.386782  1
  C  C225  1  0.899644  0.151129  0.386782  1
  C  C226  1  0.373444  0.495425  0.250267  1
  C  C227  1  0.871776  0.497682  0.247461  1
  C  C228  1  0.356037  0.532965  0.320316  1
  C  C229  1  0.852891  0.535497  0.316823  1
  C  C230  1  0.355362  0.470347  0.673586  1
  C  C231  1  0.852891  0.466125  0.678100  1
  C  C232  1  0.148624  0.535497  0.178100  1
  C  C233  1  0.648695  0.538491  0.171806  1
  C  C234  1  0.376061  0.272178  0.605850  1
  C  C235  1  0.873119  0.270326  0.608195  1
  C  C236  1  0.385514  0.520133  0.111028  1
  C  C237  1  0.887862  0.521464  0.108407  1
  C  C238  1  0.148624  0.535497  0.316823  1
  C  C239  1  0.652041  0.537900  0.310097  1
  C  C240  1  0.377665  0.274434  0.178362  1
  C  C241  1  0.877665  0.274434  0.178362  1
  C  C242  1  0.378396  0.231296  0.386728  1
  C  C243  1  0.878396  0.231296  0.386728  1
  C  C244  1  0.320496  0.323985  0.316578  1
  C  C245  1  0.820496  0.323985  0.316578  1
  C  C246  1  0.128396  0.270326  0.886728  1
  C  C247  1  0.624250  0.268171  0.891658  1
  C  C248  1  0.431250  0.446733  0.247932  1
  C  C249  1  0.929362  0.448608  0.247461  1
  C  C250  1  0.381706  0.481403  0.602873  1
  C  C251  1  0.887862  0.480158  0.608407  1
  C  C252  1  0.113793  0.408196  0.564950  1
  C  C253  1  0.618495  0.405193  0.568809  1
  C  C254  1  0.420415  0.115781  0.316704  1
  C  C255  1  0.920415  0.115781  0.316704  1
  C  C256  1  0.427492  0.823307  0.180513  1
  C  C257  1  0.931019  0.823985  0.178345  1
  C  C258  1  0.372477  0.507120  0.745136  1
  C  C259  1  0.871776  0.503940  0.747461  1
  C  C260  1  0.328470  0.343528  0.743284  1
  C  C261  1  0.828165  0.341668  0.747461  1
  C  C262  1  0.170415  0.385841  0.816704  1
  C  C263  1  0.668333  0.383442  0.822674  1
  C  C264  1  0.070496  0.177637  0.816578  1
  C  C265  1  0.567174  0.176112  0.819818  1
  C  C266  1  0.356208  0.352381  0.606527  1
  C  C267  1  0.851872  0.350492  0.608141  1
  C  C268  1  0.056640  0.528610  0.607560  1
  C  C269  1  0.557181  0.524211  0.610548  1
  C  C270  1  0.377665  0.727188  0.816561  1
  C  C271  1  0.877665  0.727188  0.816561  1
  C  C272  1  0.460721  0.190322  0.886713  1
  C  C273  1  0.965561  0.190240  0.886713  1
  C  C274  1  0.469861  0.437244  0.315337  1
  C  C275  1  0.965304  0.439264  0.316925  1
  C  C276  1  0.056640  0.473012  0.107560  1
  C  C277  1  0.555373  0.474950  0.104911  1
  C  C278  1  0.285955  0.311382  0.386713  1
  C  C279  1  0.785955  0.311382  0.386713  1
  C  C280  1  0.137723  0.093426  0.429973  1
  C  C281  1  0.637723  0.093426  0.429973  1
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