# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.05827581
_cell_length_b   28.44824557
_cell_length_c   45.64154801
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   81.72436453
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C528
_cell_volume   16778.5996068
_cell_formula_units_Z   528
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  0.409868  0.678831  0.320325  1
  C  C2  1  0.329795  0.532483  0.300160  1
  C  C3  1  0.909868  0.512164  0.320325  1
  C  C4  1  0.829795  0.699150  0.300160  1
  C  C5  1  0.909868  0.178831  0.320325  1
  C  C6  1  0.829795  0.365817  0.300160  1
  C  C7  1  0.829795  0.032483  0.300160  1
  C  C8  1  0.409868  0.345497  0.320325  1
  C  C9  1  0.409868  0.012164  0.320325  1
  C  C10  1  0.329795  0.199150  0.300160  1
  C  C11  1  0.329795  0.865817  0.300160  1
  C  C12  1  0.909868  0.845497  0.320325  1
  C  C13  1  0.423213  0.550686  0.282094  1
  C  C14  1  0.501049  0.363098  0.302858  1
  C  C15  1  0.923213  0.384019  0.282094  1
  C  C16  1  0.001049  0.529764  0.302858  1
  C  C17  1  0.923213  0.050686  0.282094  1
  C  C18  1  0.001049  0.196431  0.302858  1
  C  C19  1  0.001049  0.863098  0.302858  1
  C  C20  1  0.423213  0.217353  0.282094  1
  C  C21  1  0.423213  0.884019  0.282094  1
  C  C22  1  0.501049  0.029764  0.302858  1
  C  C23  1  0.501049  0.696431  0.302858  1
  C  C24  1  0.923213  0.717353  0.282094  1
  C  C25  1  0.619979  0.688963  0.310270  1
  C  C26  1  0.535066  0.541113  0.291595  1
  C  C27  1  0.119979  0.522296  0.310270  1
  C  C28  1  0.035066  0.707780  0.291595  1
  C  C29  1  0.119979  0.188963  0.310270  1
  C  C30  1  0.035066  0.374446  0.291595  1
  C  C31  1  0.035066  0.041113  0.291595  1
  C  C32  1  0.619979  0.355630  0.310270  1
  C  C33  1  0.619979  0.022296  0.310270  1
  C  C34  1  0.535066  0.207780  0.291595  1
  C  C35  1  0.535066  0.874446  0.291595  1
  C  C36  1  0.119979  0.855630  0.310270  1
  C  C37  1  0.210943  0.539977  0.292723  1
  C  C38  1  0.290353  0.352943  0.312936  1
  C  C39  1  0.710943  0.373310  0.292723  1
  C  C40  1  0.790353  0.519610  0.312936  1
  C  C41  1  0.710943  0.039977  0.292723  1
  C  C42  1  0.790353  0.186276  0.312936  1
  C  C43  1  0.790353  0.852943  0.312936  1
  C  C44  1  0.210943  0.206643  0.292723  1
  C  C45  1  0.210943  0.873310  0.292723  1
  C  C46  1  0.290353  0.019610  0.312936  1
  C  C47  1  0.290353  0.686276  0.312936  1
  C  C48  1  0.710943  0.706643  0.292723  1
  C  C49  1  0.565578  0.638009  0.360839  1
  C  C50  1  0.486238  0.491538  0.340796  1
  C  C51  1  0.065578  0.471342  0.360839  1
  C  C52  1  0.986238  0.658204  0.340796  1
  C  C53  1  0.065578  0.138009  0.360839  1
  C  C54  1  0.986238  0.324871  0.340796  1
  C  C55  1  0.986238  0.991538  0.340796  1
  C  C56  1  0.565578  0.304676  0.360839  1
  C  C57  1  0.565578  0.971342  0.360839  1
  C  C58  1  0.486238  0.158204  0.340796  1
  C  C59  1  0.486238  0.824871  0.340796  1
  C  C60  1  0.065578  0.804676  0.360839  1
  C  C61  1  0.574625  0.512179  0.320311  1
  C  C62  1  0.654606  0.324491  0.341174  1
  C  C63  1  0.074625  0.345512  0.320311  1
  C  C64  1  0.154606  0.491157  0.341174  1
  C  C65  1  0.074625  0.012179  0.320311  1
  C  C66  1  0.154606  0.157824  0.341174  1
  C  C67  1  0.154606  0.824491  0.341174  1
  C  C68  1  0.574625  0.178845  0.320311  1
  C  C69  1  0.574625  0.845512  0.320311  1
  C  C70  1  0.654606  0.991157  0.341174  1
  C  C71  1  0.654606  0.657824  0.341174  1
  C  C72  1  0.074625  0.678845  0.320311  1
  C  C73  1  0.776155  0.648141  0.350784  1
  C  C74  1  0.700568  0.501946  0.330467  1
  C  C75  1  0.276155  0.481474  0.350784  1
  C  C76  1  0.200568  0.668612  0.330467  1
  C  C77  1  0.276155  0.148141  0.350784  1
  C  C78  1  0.200568  0.335279  0.330467  1
  C  C79  1  0.200568  0.001946  0.330467  1
  C  C80  1  0.776155  0.314807  0.350784  1
  C  C81  1  0.776155  0.981474  0.350784  1
  C  C82  1  0.700568  0.168612  0.330467  1
  C  C83  1  0.700568  0.835279  0.330467  1
  C  C84  1  0.276155  0.814807  0.350784  1
  C  C85  1  0.365373  0.501302  0.331105  1
  C  C86  1  0.443821  0.314301  0.351286  1
  C  C87  1  0.865373  0.334636  0.331105  1
  C  C88  1  0.943821  0.480968  0.351286  1
  C  C89  1  0.865373  0.001302  0.331105  1
  C  C90  1  0.943821  0.147634  0.351286  1
  C  C91  1  0.943821  0.814301  0.351286  1
  C  C92  1  0.365373  0.167969  0.331105  1
  C  C93  1  0.365373  0.834636  0.331105  1
  C  C94  1  0.443821  0.980968  0.351286  1
  C  C95  1  0.443821  0.647634  0.351286  1
  C  C96  1  0.865373  0.667969  0.331105  1
  C  C97  1  0.721361  0.597545  0.400998  1
  C  C98  1  0.643497  0.451228  0.380801  1
  C  C99  1  0.221361  0.430878  0.400998  1
  C  C100  1  0.143497  0.617895  0.380801  1
  C  C101  1  0.221361  0.097545  0.400998  1
  C  C102  1  0.143497  0.284561  0.380801  1
  C  C103  1  0.143497  0.951228  0.380801  1
  C  C104  1  0.721361  0.264211  0.400998  1
  C  C105  1  0.721361  0.930878  0.400998  1
  C  C106  1  0.643497  0.117895  0.380801  1
  C  C107  1  0.643497  0.784561  0.380801  1
  C  C108  1  0.221361  0.764211  0.400998  1
  C  C109  1  0.732517  0.471011  0.361168  1
  C  C110  1  0.810302  0.284282  0.381079  1
  C  C111  1  0.232517  0.304344  0.361168  1
  C  C112  1  0.310302  0.450949  0.381079  1
  C  C113  1  0.232517  0.971011  0.361168  1
  C  C114  1  0.310302  0.117615  0.381079  1
  C  C115  1  0.310302  0.784282  0.381079  1
  C  C116  1  0.732517  0.137677  0.361168  1
  C  C117  1  0.732517  0.804344  0.361168  1
  C  C118  1  0.810302  0.950949  0.381079  1
  C  C119  1  0.810302  0.617615  0.381079  1
  C  C120  1  0.232517  0.637677  0.361168  1
  C  C121  1  0.932335  0.607724  0.390895  1
  C  C122  1  0.854790  0.461245  0.370860  1
  C  C123  1  0.432335  0.441057  0.390895  1
  C  C124  1  0.354790  0.627912  0.370860  1
  C  C125  1  0.432335  0.107724  0.390895  1
  C  C126  1  0.354790  0.294579  0.370860  1
  C  C127  1  0.354790  0.961245  0.370860  1
  C  C128  1  0.932335  0.274391  0.390895  1
  C  C129  1  0.932335  0.941057  0.390895  1
  C  C130  1  0.854790  0.127912  0.370860  1
  C  C131  1  0.854790  0.794579  0.370860  1
  C  C132  1  0.432335  0.774391  0.390895  1
  C  C133  1  0.521010  0.461248  0.370857  1
  C  C134  1  0.599302  0.274123  0.391161  1
  C  C135  1  0.021010  0.294582  0.370857  1
  C  C136  1  0.099302  0.440790  0.391161  1
  C  C137  1  0.021010  0.961248  0.370857  1
  C  C138  1  0.099302  0.107457  0.391161  1
  C  C139  1  0.099302  0.774123  0.391161  1
  C  C140  1  0.521010  0.127915  0.370857  1
  C  C141  1  0.521010  0.794582  0.370857  1
  C  C142  1  0.599302  0.940790  0.391161  1
  C  C143  1  0.599302  0.607457  0.391161  1
  C  C144  1  0.021010  0.627915  0.370857  1
  C  C145  1  0.877073  0.557191  0.441046  1
  C  C146  1  0.798995  0.410732  0.420992  1
  C  C147  1  0.377073  0.390525  0.441046  1
  C  C148  1  0.298995  0.577398  0.420992  1
  C  C149  1  0.377073  0.057191  0.441046  1
  C  C150  1  0.298995  0.244065  0.420992  1
  C  C151  1  0.298995  0.910732  0.420992  1
  C  C152  1  0.877073  0.223858  0.441046  1
  C  C153  1  0.877073  0.890525  0.441046  1
  C  C154  1  0.798995  0.077398  0.420992  1
  C  C155  1  0.798995  0.744065  0.420992  1
  C  C156  1  0.377073  0.723858  0.441046  1
  C  C157  1  0.888133  0.430732  0.401143  1
  C  C158  1  0.965850  0.244041  0.421016  1
  C  C159  1  0.388133  0.264065  0.401143  1
  C  C160  1  0.465850  0.410708  0.421016  1
  C  C161  1  0.388133  0.930732  0.401143  1
  C  C162  1  0.465850  0.077374  0.421016  1
  C  C163  1  0.465850  0.744041  0.421016  1
  C  C164  1  0.888133  0.097399  0.401143  1
  C  C165  1  0.888133  0.764065  0.401143  1
  C  C166  1  0.965850  0.910708  0.421016  1
  C  C167  1  0.965850  0.577374  0.421016  1
  C  C168  1  0.388133  0.597399  0.401143  1
  C  C169  1  0.088067  0.567341  0.430973  1
  C  C170  1  0.010268  0.420768  0.411031  1
  C  C171  1  0.588067  0.400675  0.430973  1
  C  C172  1  0.510268  0.587435  0.411031  1
  C  C173  1  0.588067  0.067341  0.430973  1
  C  C174  1  0.510268  0.254101  0.411031  1
  C  C175  1  0.510268  0.920768  0.411031  1
  C  C176  1  0.088067  0.234008  0.430973  1
  C  C177  1  0.088067  0.900675  0.430973  1
  C  C178  1  0.010268  0.087435  0.411031  1
  C  C179  1  0.010268  0.754101  0.411031  1
  C  C180  1  0.588067  0.734008  0.430973  1
  C  C181  1  0.676847  0.420812  0.410988  1
  C  C182  1  0.754871  0.233843  0.431137  1
  C  C183  1  0.176847  0.254145  0.410988  1
  C  C184  1  0.254871  0.400509  0.431137  1
  C  C185  1  0.176847  0.920812  0.410988  1
  C  C186  1  0.254871  0.067176  0.431137  1
  C  C187  1  0.254871  0.733843  0.431137  1
  C  C188  1  0.676847  0.087479  0.410988  1
  C  C189  1  0.676847  0.754145  0.410988  1
  C  C190  1  0.754871  0.900509  0.431137  1
  C  C191  1  0.754871  0.567176  0.431137  1
  C  C192  1  0.176847  0.587479  0.410988  1
  C  C193  1  0.032543  0.516829  0.481104  1
  C  C194  1  0.954648  0.370308  0.461110  1
  C  C195  1  0.532543  0.350162  0.481104  1
  C  C196  1  0.454648  0.536975  0.461110  1
  C  C197  1  0.532543  0.016829  0.481104  1
  C  C198  1  0.454648  0.203642  0.461110  1
  C  C199  1  0.454648  0.870308  0.461110  1
  C  C200  1  0.032543  0.183495  0.481104  1
  C  C201  1  0.032543  0.850162  0.481104  1
  C  C202  1  0.954648  0.036975  0.461110  1
  C  C203  1  0.954648  0.703642  0.461110  1
  C  C204  1  0.532543  0.683495  0.481104  1
  C  C205  1  0.043725  0.390404  0.441166  1
  C  C206  1  0.121361  0.203679  0.461073  1
  C  C207  1  0.543725  0.223738  0.441166  1
  C  C208  1  0.621361  0.370345  0.461073  1
  C  C209  1  0.543725  0.890404  0.441166  1
  C  C210  1  0.621361  0.037012  0.461073  1
  C  C211  1  0.621361  0.703679  0.461073  1
  C  C212  1  0.043725  0.057071  0.441166  1
  C  C213  1  0.043725  0.723738  0.441166  1
  C  C214  1  0.121361  0.870345  0.461073  1
  C  C215  1  0.121361  0.537012  0.461073  1
  C  C216  1  0.543725  0.557071  0.441166  1
  C  C217  1  0.243530  0.526925  0.471084  1
  C  C218  1  0.165908  0.380381  0.451114  1
  C  C219  1  0.743530  0.360258  0.471084  1
  C  C220  1  0.665908  0.547047  0.451114  1
  C  C221  1  0.743530  0.026925  0.471084  1
  C  C222  1  0.665908  0.213714  0.451114  1
  C  C223  1  0.665908  0.880381  0.451114  1
  C  C224  1  0.243530  0.193592  0.471084  1
  C  C225  1  0.243530  0.860258  0.471084  1
  C  C226  1  0.165908  0.047047  0.451114  1
  C  C227  1  0.165908  0.713714  0.451114  1
  C  C228  1  0.743530  0.693592  0.471084  1
  C  C229  1  0.832492  0.380391  0.451103  1
  C  C230  1  0.910327  0.193536  0.471139  1
  C  C231  1  0.332492  0.213725  0.451103  1
  C  C232  1  0.410327  0.360203  0.471139  1
  C  C233  1  0.332492  0.880391  0.451103  1
  C  C234  1  0.410327  0.026870  0.471139  1
  C  C235  1  0.410327  0.693536  0.471139  1
  C  C236  1  0.832492  0.047058  0.451103  1
  C  C237  1  0.832492  0.713725  0.451103  1
  C  C238  1  0.910327  0.860203  0.471139  1
  C  C239  1  0.910327  0.526870  0.471139  1
  C  C240  1  0.332492  0.547058  0.451103  1
  C  C241  1  0.187984  0.476471  0.521157  1
  C  C242  1  0.110313  0.329917  0.501196  1
  C  C243  1  0.687984  0.309804  0.521157  1
  C  C244  1  0.610313  0.496584  0.501196  1
  C  C245  1  0.687984  0.976471  0.521157  1
  C  C246  1  0.610313  0.163251  0.501196  1
  C  C247  1  0.610313  0.829917  0.501196  1
  C  C248  1  0.187984  0.143138  0.521157  1
  C  C249  1  0.187984  0.809804  0.521157  1
  C  C250  1  0.110313  0.996584  0.501196  1
  C  C251  1  0.110313  0.663251  0.501196  1
  C  C252  1  0.687984  0.643138  0.521157  1
  C  C253  1  0.199282  0.350064  0.481201  1
  C  C254  1  0.276952  0.163285  0.501162  1
  C  C255  1  0.699282  0.183398  0.481201  1
  C  C256  1  0.776952  0.329951  0.501162  1
  C  C257  1  0.699282  0.850064  0.481201  1
  C  C258  1  0.776952  0.996618  0.501162  1
  C  C259  1  0.776952  0.663285  0.501162  1
  C  C260  1  0.199282  0.016731  0.481201  1
  C  C261  1  0.199282  0.683398  0.481201  1
  C  C262  1  0.276952  0.829951  0.501162  1
  C  C263  1  0.276952  0.496618  0.501162  1
  C  C264  1  0.699282  0.516731  0.481201  1
  C  C265  1  0.399124  0.486535  0.511169  1
  C  C266  1  0.321489  0.340019  0.491171  1
  C  C267  1  0.899124  0.319868  0.511169  1
  C  C268  1  0.821489  0.506686  0.491171  1
  C  C269  1  0.899124  0.986535  0.511169  1
  C  C270  1  0.821489  0.173352  0.491171  1
  C  C271  1  0.821489  0.840019  0.491171  1
  C  C272  1  0.399124  0.153202  0.511169  1
  C  C273  1  0.399124  0.819868  0.511169  1
  C  C274  1  0.321489  0.006686  0.491171  1
  C  C275  1  0.321489  0.673352  0.491171  1
  C  C276  1  0.899124  0.653202  0.511169  1
  C  C277  1  0.988141  0.340000  0.491189  1
  C  C278  1  0.065776  0.153183  0.511188  1
  C  C279  1  0.488141  0.173334  0.491189  1
  C  C280  1  0.565776  0.319850  0.511188  1
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