# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   17.11777786
_cell_length_b   24.99376575
_cell_length_c   49.81208193
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   95.53506412
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C576
_cell_volume   21212.120175
_cell_formula_units_Z   576
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  0.593475  0.570833  0.312345  1
  C  C2  1  0.260142  0.237499  0.312345  1
  C  C3  1  0.294770  0.554222  0.351388  1
  C  C4  1  0.001333  0.537405  0.387621  1
  C  C5  1  0.926808  0.904166  0.312344  1
  C  C6  1  0.961436  0.220888  0.351388  1
  C  C7  1  0.668000  0.204072  0.387621  1
  C  C8  1  0.628103  0.887556  0.351388  1
  C  C9  1  0.334666  0.870739  0.387620  1
  C  C10  1  0.748084  0.633843  0.383749  1
  C  C11  1  0.414751  0.300510  0.383749  1
  C  C12  1  0.345869  0.704643  0.322316  1
  C  C13  1  0.043558  0.650591  0.345126  1
  C  C14  1  0.081417  -0.032823  0.383748  1
  C  C15  1  0.012536  0.371310  0.322316  1
  C  C16  1  0.710225  0.317258  0.345126  1
  C  C17  1  0.679202  0.037977  0.322315  1
  C  C18  1  0.376891  -0.016075  0.345125  1
  C  C19  1  0.732026  0.518709  0.370612  1
  C  C20  1  0.398692  0.185375  0.370612  1
  C  C21  1  0.309516  0.511579  0.301029  1
  C  C22  1  0.027213  0.536676  0.332021  1
  C  C23  1  0.065359  0.852042  0.370611  1
  C  C24  1  0.976182  0.178245  0.301029  1
  C  C25  1  0.693880  0.203342  0.332021  1
  C  C26  1  0.642848  0.844912  0.301028  1
  C  C27  1  0.360546  0.870009  0.332021  1
  C  C28  1  0.453270  0.627757  0.337217  1
  C  C29  1  0.119937  0.294423  0.337217  1
  C  C30  1  0.157358  0.610272  0.377142  1
  C  C31  1  0.758268  0.703928  0.311901  1
  C  C32  1  0.786603  0.961090  0.337217  1
  C  C33  1  0.824024  0.276939  0.377142  1
  C  C34  1  0.424935  0.370595  0.311901  1
  C  C35  1  0.490690  0.943606  0.377142  1
  C  C36  1  0.091601  0.037262  0.311900  1
  C  C37  1  0.444575  0.563392  0.329680  1
  C  C38  1  0.111242  0.230058  0.329680  1
  C  C39  1  0.148086  0.545689  0.369690  1
  C  C40  1  0.729129  0.518898  0.288404  1
  C  C41  1  0.777908  0.896725  0.329680  1
  C  C42  1  0.814752  0.212356  0.369690  1
  C  C43  1  0.395796  0.185565  0.288404  1
  C  C44  1  0.481418  0.879023  0.369689  1
  C  C45  1  0.062462  0.852231  0.288403  1
  C  C46  1  0.603083  0.637102  0.320356  1
  C  C47  1  0.269750  0.303769  0.320356  1
  C  C48  1  0.304014  0.618559  0.358441  1
  C  C49  1  0.918110  0.751746  0.311218  1
  C  C50  1  0.936416  -0.029564  0.320355  1
  C  C51  1  0.970680  0.285225  0.358440  1
  C  C52  1  0.584777  0.418412  0.311218  1
  C  C53  1  0.637346  0.951892  0.358440  1
  C  C54  1  0.251443  0.085079  0.311216  1
  C  C55  1  0.674341  0.677697  0.310530  1
  C  C56  1  0.341008  0.344364  0.310530  1
  C  C57  1  0.371773  0.656448  0.341933  1
  C  C58  1  0.073470  0.637366  0.375518  1
  C  C59  1  0.007674  0.011030  0.310529  1
  C  C60  1  0.038440  0.323114  0.341933  1
  C  C61  1  0.740136  0.304032  0.375518  1
  C  C62  1  0.705106  -0.010219  0.341932  1
  C  C63  1  0.406802  -0.029300  0.375518  1
  C  C64  1  0.651191  0.544019  0.293109  1
  C  C65  1  0.317858  0.210686  0.293109  1
  C  C66  1  0.353088  0.533493  0.327430  1
  C  C67  1  0.057394  0.522683  0.362346  1
  C  C68  1  0.984523  0.877352  0.293108  1
  C  C69  1  0.019755  0.200159  0.327430  1
  C  C70  1  0.724060  0.189349  0.362346  1
  C  C71  1  0.686421  0.866826  0.327429  1
  C  C72  1  0.390726  0.856017  0.362346  1
  C  C73  1  0.501333  0.537405  0.387621  1
  C  C74  1  0.168000  0.204072  0.387621  1
  C  C75  1  0.093475  0.570833  0.312345  1
  C  C76  1  0.794770  0.554222  0.351388  1
  C  C77  1  0.834666  0.870739  0.387620  1
  C  C78  1  0.760142  0.237499  0.312345  1
  C  C79  1  0.461436  0.220888  0.351388  1
  C  C80  1  0.426808  0.904166  0.312344  1
  C  C81  1  0.128103  0.887556  0.351388  1
  C  C82  1  0.543558  0.650591  0.345126  1
  C  C83  1  0.210225  0.317258  0.345126  1
  C  C84  1  0.248084  0.633843  0.383749  1
  C  C85  1  0.845869  0.704643  0.322316  1
  C  C86  1  0.876891  -0.016075  0.345125  1
  C  C87  1  0.914751  0.300510  0.383749  1
  C  C88  1  0.512536  0.371310  0.322316  1
  C  C89  1  0.581417  -0.032823  0.383748  1
  C  C90  1  0.179202  0.037977  0.322315  1
  C  C91  1  0.527213  0.536676  0.332021  1
  C  C92  1  0.193880  0.203342  0.332021  1
  C  C93  1  0.232026  0.518709  0.370612  1
  C  C94  1  0.809516  0.511579  0.301029  1
  C  C95  1  0.860546  0.870009  0.332021  1
  C  C96  1  0.898692  0.185375  0.370612  1
  C  C97  1  0.476182  0.178245  0.301029  1
  C  C98  1  0.565359  0.852042  0.370611  1
  C  C99  1  0.142848  0.844912  0.301028  1
  C  C100  1  0.657358  0.610272  0.377142  1
  C  C101  1  0.324024  0.276939  0.377142  1
  C  C102  1  0.258268  0.703928  0.311901  1
  C  C103  1  0.953270  0.627757  0.337217  1
  C  C104  1  0.990690  0.943606  0.377142  1
  C  C105  1  0.924935  0.370595  0.311901  1
  C  C106  1  0.619937  0.294423  0.337217  1
  C  C107  1  0.591601  0.037262  0.311900  1
  C  C108  1  0.286603  0.961090  0.337217  1
  C  C109  1  0.648086  0.545689  0.369690  1
  C  C110  1  0.314752  0.212356  0.369690  1
  C  C111  1  0.229129  0.518898  0.288404  1
  C  C112  1  0.944575  0.563392  0.329680  1
  C  C113  1  0.981418  0.879023  0.369689  1
  C  C114  1  0.895796  0.185565  0.288404  1
  C  C115  1  0.611242  0.230058  0.329680  1
  C  C116  1  0.562462  0.852231  0.288403  1
  C  C117  1  0.277908  0.896725  0.329680  1
  C  C118  1  0.418110  0.751746  0.311218  1
  C  C119  1  0.084777  0.418412  0.311218  1
  C  C120  1  0.103083  0.637102  0.320356  1
  C  C121  1  0.804014  0.618559  0.358441  1
  C  C122  1  0.751443  0.085079  0.311216  1
  C  C123  1  0.769750  0.303769  0.320356  1
  C  C124  1  0.470680  0.285225  0.358440  1
  C  C125  1  0.436416  -0.029564  0.320355  1
  C  C126  1  0.137346  0.951892  0.358440  1
  C  C127  1  0.573470  0.637366  0.375518  1
  C  C128  1  0.240136  0.304032  0.375518  1
  C  C129  1  0.174341  0.677697  0.310530  1
  C  C130  1  0.871773  0.656448  0.341933  1
  C  C131  1  0.906802  -0.029300  0.375518  1
  C  C132  1  0.841008  0.344364  0.310530  1
  C  C133  1  0.538440  0.323114  0.341933  1
  C  C134  1  0.507674  0.011030  0.310529  1
  C  C135  1  0.205106  -0.010219  0.341932  1
  C  C136  1  0.557394  0.522683  0.362346  1
  C  C137  1  0.224060  0.189349  0.362346  1
  C  C138  1  0.151191  0.544019  0.293109  1
  C  C139  1  0.853088  0.533493  0.327430  1
  C  C140  1  0.890726  0.856017  0.362346  1
  C  C141  1  0.817858  0.210686  0.293109  1
  C  C142  1  0.519755  0.200159  0.327430  1
  C  C143  1  0.484523  0.877352  0.293108  1
  C  C144  1  0.186421  0.866826  0.327429  1
  C  C145  1  0.710358  0.519928  0.426014  1
  C  C146  1  0.377024  0.186594  0.426014  1
  C  C147  1  0.418430  0.502840  0.463309  1
  C  C148  1  0.126285  0.485643  0.500972  1
  C  C149  1  0.043690  0.853262  0.426014  1
  C  C150  1  0.085097  0.169507  0.463309  1
  C  C151  1  0.792951  0.152309  0.500972  1
  C  C152  1  0.751763  0.836174  0.463308  1
  C  C153  1  0.459618  0.818977  0.500971  1
  C  C154  1  0.872502  0.582349  0.496155  1
  C  C155  1  0.539168  0.249016  0.496155  1
  C  C156  1  0.456527  0.616770  0.420808  1
  C  C157  1  0.164146  0.599671  0.458704  1
  C  C158  1  0.205835  0.915683  0.496154  1
  C  C159  1  0.123193  0.283437  0.420808  1
  C  C160  1  0.830812  0.266338  0.458704  1
  C  C161  1  0.789859  0.950104  0.420807  1
  C  C162  1  0.497478  0.933005  0.458703  1
  C  C163  1  0.856320  0.467383  0.483045  1
  C  C164  1  0.522986  0.134050  0.483045  1
  C  C165  1  0.440444  0.501792  0.407680  1
  C  C166  1  0.147855  0.484343  0.445580  1
  C  C167  1  0.189652  0.800717  0.483044  1
  C  C168  1  0.107111  0.168459  0.407680  1
  C  C169  1  0.814522  0.151009  0.445580  1
  C  C170  1  0.773777  0.835126  0.407679  1
  C  C171  1  0.481188  0.817677  0.445580  1
  C  C172  1  0.573337  0.576190  0.451843  1
  C  C173  1  0.240003  0.242857  0.451843  1
  C  C174  1  0.281518  0.558907  0.489569  1
  C  C175  1  0.865442  0.593183  0.414538  1
  C  C176  1  0.906670  0.909524  0.451842  1
  C  C177  1  0.948185  0.225574  0.489569  1
  C  C178  1  0.532109  0.259850  0.414538  1
  C  C179  1  0.614851  0.892241  0.489568  1
  C  C180  1  0.198775  0.926517  0.414538  1
  C  C181  1  0.564228  0.511487  0.444464  1
  C  C182  1  0.230895  0.178154  0.444464  1
  C  C183  1  0.272411  0.494213  0.482196  1
  C  C184  1  0.856336  0.528465  0.407210  1
  C  C185  1  0.897561  0.844821  0.444464  1
  C  C186  1  0.939077  0.160880  0.482196  1
  C  C187  1  0.523002  0.195132  0.407210  1
  C  C188  1  0.605744  0.827547  0.482195  1
  C  C189  1  0.189668  0.861799  0.407209  1
  C  C190  1  0.719479  0.584643  0.433382  1
  C  C191  1  0.386146  0.251309  0.433382  1
  C  C192  1  0.427526  0.567531  0.470691  1
  C  C193  1  0.010426  0.602014  0.395044  1
  C  C194  1  0.052812  0.917977  0.433381  1
  C  C195  1  0.094193  0.234198  0.470691  1
  C  C196  1  0.677093  0.268680  0.395044  1
  C  C197  1  0.760859  0.900865  0.470691  1
  C  C198  1  0.343759  0.935348  0.395043  1
  C  C199  1  0.781683  0.620276  0.413729  1
  C  C200  1  0.448350  0.286942  0.413729  1
  C  C201  1  0.489476  0.603036  0.450916  1
  C  C202  1  0.197722  0.585889  0.488713  1
  C  C203  1  0.115016  0.953610  0.413728  1
  C  C204  1  0.156143  0.269703  0.450916  1
  C  C205  1  0.864389  0.252556  0.488713  1
  C  C206  1  0.822809  0.936370  0.450915  1
  C  C207  1  0.531055  0.919223  0.488712  1
  C  C208  1  0.765501  0.504764  0.400685  1
  C  C209  1  0.432168  0.171431  0.400685  1
  C  C210  1  0.473298  0.488069  0.437791  1
  C  C211  1  0.181479  0.470659  0.475585  1
  C  C212  1  0.098834  0.838098  0.400684  1
  C  C213  1  0.139965  0.154735  0.437791  1
  C  C214  1  0.848145  0.137326  0.475585  1
  C  C215  1  0.806631  0.821402  0.437791  1
  C  C216  1  0.514811  0.803993  0.475584  1
  C  C217  1  0.626285  0.485643  0.500972  1
  C  C218  1  0.292951  0.152309  0.500972  1
  C  C219  1  0.210358  0.519928  0.426014  1
  C  C220  1  0.918430  0.502840  0.463309  1
  C  C221  1  0.959618  0.818977  0.500971  1
  C  C222  1  0.877024  0.186594  0.426014  1
  C  C223  1  0.585097  0.169507  0.463309  1
  C  C224  1  0.543690  0.853262  0.426014  1
  C  C225  1  0.251763  0.836174  0.463308  1
  C  C226  1  0.664146  0.599671  0.458704  1
  C  C227  1  0.330812  0.266338  0.458704  1
  C  C228  1  0.372502  0.582349  0.496155  1
  C  C229  1  0.956527  0.616770  0.420808  1
  C  C230  1  -0.002522  0.933005  0.458703  1
  C  C231  1  0.039168  0.249016  0.496155  1
  C  C232  1  0.623193  0.283437  0.420808  1
  C  C233  1  0.705835  0.915683  0.496154  1
  C  C234  1  0.289859  0.950104  0.420807  1
  C  C235  1  0.647855  0.484343  0.445580  1
  C  C236  1  0.314522  0.151009  0.445580  1
  C  C237  1  0.356319  0.467383  0.483045  1
  C  C238  1  0.940444  0.501792  0.407680  1
  C  C239  1  0.981188  0.817677  0.445580  1
  C  C240  1  0.022986  0.134050  0.483045  1
  C  C241  1  0.607111  0.168459  0.407680  1
  C  C242  1  0.689652  0.800717  0.483044  1
  C  C243  1  0.273777  0.835126  0.407679  1
  C  C244  1  0.781518  0.558907  0.489569  1
  C  C245  1  0.448185  0.225574  0.489569  1
  C  C246  1  0.365442  0.593183  0.414538  1
  C  C247  1  0.073337  0.576190  0.451843  1
  C  C248  1  0.114851  0.892241  0.489568  1
  C  C249  1  0.032109  0.259850  0.414538  1
  C  C250  1  0.740003  0.242857  0.451843  1
  C  C251  1  0.698775  0.926517  0.414538  1
  C  C252  1  0.406670  0.909524  0.451842  1
  C  C253  1  0.772411  0.494213  0.482196  1
  C  C254  1  0.439077  0.160880  0.482196  1
  C  C255  1  0.356336  0.528465  0.407210  1
  C  C256  1  0.064228  0.511487  0.444464  1
  C  C257  1  0.105744  0.827547  0.482195  1
  C  C258  1  0.023002  0.195132  0.407210  1
  C  C259  1  0.730895  0.178154  0.444464  1
  C  C260  1  0.689668  0.861799  0.407209  1
  C  C261  1  0.397561  0.844821  0.444464  1
  C  C262  1  0.510426  0.602014  0.395044  1
  C  C263  1  0.177093  0.268680  0.395044  1
  C  C264  1  0.219479  0.584643  0.433382  1
  C  C265  1  0.927526  0.567531  0.470691  1
  C  C266  1  0.843759  0.935348  0.395043  1
  C  C267  1  0.886146  0.251309  0.433382  1
  C  C268  1  0.594193  0.234198  0.470691  1
  C  C269  1  0.552812  0.917977  0.433381  1
  C  C270  1  0.260859  0.900865  0.470691  1
  C  C271  1  0.697722  0.585889  0.488713  1
  C  C272  1  0.364389  0.252556  0.488713  1
  C  C273  1  0.281683  0.620276  0.413729  1
  C  C274  1  0.989476  0.603036  0.450916  1
  C  C275  1  0.031055  0.919223  0.488712  1
  C  C276  1  0.948350  0.286942  0.413729  1
  C  C277  1  0.656143  0.269703  0.450916  1
  C  C278  1  0.615016  0.953610  0.413728  1
  C  C279  1  0.322809  0.936370  0.450915  1
  C  C280  1  0.681479  0.470659  0.475585  1
  C  C281  1  0.348145  0.137326  0.475585  1
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