# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   30.87222448
_cell_length_b   18.17652796
_cell_length_c   48.60659787
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   82.51176999
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C864
_cell_volume   27042.9695493
_cell_formula_units_Z   864
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  0.719778  0.151044  0.318062  1
  C  C2  1  0.386444  0.151044  0.318061  1
  C  C3  1  0.564874  0.169628  0.293467  1
  C  C4  1  0.053110  0.151044  0.318061  1
  C  C5  1  0.231542  0.169627  0.293467  1
  C  C6  1  0.553110  0.651044  0.318061  1
  C  C7  1  0.731540  0.669628  0.293468  1
  C  C8  1  0.898209  0.169627  0.293469  1
  C  C9  1  0.219777  0.651044  0.318061  1
  C  C10  1  0.398208  0.669627  0.293468  1
  C  C11  1  0.886444  0.651044  0.318061  1
  C  C12  1  0.064877  0.669627  0.293469  1
  C  C13  1  0.734337  0.435609  0.276533  1
  C  C14  1  0.401003  0.435607  0.276534  1
  C  C15  1  0.553588  0.435400  0.305351  1
  C  C16  1  0.067667  0.435606  0.276535  1
  C  C17  1  0.220255  0.435400  0.305351  1
  C  C18  1  0.567667  0.935608  0.276532  1
  C  C19  1  0.720255  0.935399  0.305351  1
  C  C20  1  0.886923  0.435400  0.305351  1
  C  C21  1  0.234333  0.935607  0.276535  1
  C  C22  1  0.386921  0.935400  0.305351  1
  C  C23  1  0.901001  0.935608  0.276532  1
  C  C24  1  0.053589  0.935399  0.305351  1
  C  C25  1  0.781488  0.428807  0.285327  1
  C  C26  1  0.448153  0.428806  0.285327  1
  C  C27  1  0.606955  0.413269  0.311445  1
  C  C28  1  0.114819  0.428807  0.285327  1
  C  C29  1  0.273622  0.413270  0.311444  1
  C  C30  1  0.614823  0.928807  0.285326  1
  C  C31  1  0.773623  0.913268  0.311444  1
  C  C32  1  0.940289  0.413269  0.311444  1
  C  C33  1  0.281487  0.928807  0.285327  1
  C  C34  1  0.440289  0.913269  0.311444  1
  C  C35  1  0.948157  0.928806  0.285327  1
  C  C36  1  0.106955  0.913269  0.311444  1
  C  C37  1  0.793718  0.240272  0.282621  1
  C  C38  1  0.460384  0.240274  0.282620  1
  C  C39  1  0.615450  0.162788  0.299393  1
  C  C40  1  0.127051  0.240273  0.282620  1
  C  C41  1  0.282116  0.162787  0.299394  1
  C  C42  1  0.627051  0.740272  0.282620  1
  C  C43  1  0.782116  0.662788  0.299393  1
  C  C44  1  0.948784  0.162788  0.299394  1
  C  C45  1  0.293718  0.740273  0.282620  1
  C  C46  1  0.448783  0.662787  0.299394  1
  C  C47  1  0.960385  0.740271  0.282621  1
  C  C48  1  0.115450  0.662787  0.299395  1
  C  C49  1  0.807207  0.179894  0.307911  1
  C  C50  1  0.473873  0.179893  0.307910  1
  C  C51  1  0.654139  0.184227  0.279581  1
  C  C52  1  0.140540  0.179894  0.307910  1
  C  C53  1  0.320805  0.184227  0.279581  1
  C  C54  1  0.640540  0.679894  0.307910  1
  C  C55  1  0.820806  0.684227  0.279582  1
  C  C56  1  0.987471  0.184226  0.279583  1
  C  C57  1  0.307207  0.679893  0.307911  1
  C  C58  1  0.487473  0.684227  0.279582  1
  C  C59  1  0.973875  0.679893  0.307910  1
  C  C60  1  0.154138  0.684226  0.279583  1
  C  C61  1  0.799793  0.404714  0.315264  1
  C  C62  1  0.466459  0.404713  0.315265  1
  C  C63  1  0.644619  0.426792  0.291187  1
  C  C64  1  0.133124  0.404714  0.315264  1
  C  C65  1  0.311289  0.426791  0.291186  1
  C  C66  1  0.633126  0.904714  0.315264  1
  C  C67  1  0.811287  0.926789  0.291186  1
  C  C68  1  0.977957  0.426789  0.291188  1
  C  C69  1  0.299791  0.904713  0.315264  1
  C  C70  1  0.477955  0.926790  0.291186  1
  C  C71  1  0.966460  0.904713  0.315265  1
  C  C72  1  0.144624  0.926789  0.291188  1
  C  C73  1  0.873135  0.493892  0.279522  1
  C  C74  1  0.539801  0.493893  0.279522  1
  C  C75  1  0.695325  0.417939  0.296825  1
  C  C76  1  0.206467  0.493895  0.279521  1
  C  C77  1  0.361993  0.417938  0.296826  1
  C  C78  1  0.706468  0.993895  0.279521  1
  C  C79  1  0.861991  0.917937  0.296825  1
  C  C80  1  0.028660  0.417936  0.296828  1
  C  C81  1  0.373134  0.993893  0.279521  1
  C  C82  1  0.528658  0.917938  0.296826  1
  C  C83  1  0.039801  0.993893  0.279522  1
  C  C84  1  0.195326  0.917936  0.296827  1
  C  C85  1  0.860532  0.156096  0.313716  1
  C  C86  1  0.527199  0.156096  0.313715  1
  C  C87  1  0.701184  0.178527  0.288535  1
  C  C88  1  0.193865  0.156096  0.313715  1
  C  C89  1  0.367851  0.178527  0.288534  1
  C  C90  1  0.693866  0.656096  0.313715  1
  C  C91  1  0.867850  0.678526  0.288534  1
  C  C92  1  0.034516  0.178527  0.288534  1
  C  C93  1  0.360532  0.656095  0.313716  1
  C  C94  1  0.534516  0.678526  0.288534  1
  C  C95  1  0.027199  0.656095  0.313715  1
  C  C96  1  0.201182  0.678526  0.288534  1
  C  C97  1  0.698857  0.091720  0.370174  1
  C  C98  1  0.365523  0.091720  0.370173  1
  C  C99  1  0.542839  0.120084  0.344635  1
  C  C100  1  0.032188  0.091721  0.370174  1
  C  C101  1  0.209506  0.120084  0.344635  1
  C  C102  1  0.532190  0.591720  0.370174  1
  C  C103  1  0.709505  0.620084  0.344635  1
  C  C104  1  0.876172  0.120085  0.344635  1
  C  C105  1  0.198856  0.591720  0.370173  1
  C  C106  1  0.376172  0.620084  0.344635  1
  C  C107  1  0.865523  0.591719  0.370174  1
  C  C108  1  0.042840  0.620084  0.344635  1
  C  C109  1  0.711595  0.387830  0.328793  1
  C  C110  1  0.378261  0.387832  0.328792  1
  C  C111  1  0.533608  0.364912  0.354862  1
  C  C112  1  0.044925  0.387835  0.328788  1
  C  C113  1  0.200274  0.364912  0.354862  1
  C  C114  1  0.544927  0.887832  0.328790  1
  C  C115  1  0.700275  0.864911  0.354862  1
  C  C116  1  0.866942  0.364912  0.354862  1
  C  C117  1  0.211592  0.887834  0.328788  1
  C  C118  1  0.366940  0.864912  0.354862  1
  C  C119  1  0.878261  0.887829  0.328793  1
  C  C120  1  0.033608  0.864911  0.354862  1
  C  C121  1  0.762716  0.380668  0.337303  1
  C  C122  1  0.429383  0.380668  0.337303  1
  C  C123  1  0.585790  0.353252  0.363365  1
  C  C124  1  0.096049  0.380667  0.337304  1
  C  C125  1  0.252457  0.353252  0.363365  1
  C  C126  1  0.596050  0.880668  0.337302  1
  C  C127  1  0.752457  0.853251  0.363365  1
  C  C128  1  0.919123  0.353253  0.363365  1
  C  C129  1  0.262715  0.880668  0.337303  1
  C  C130  1  0.419123  0.853253  0.363365  1
  C  C131  1  0.929384  0.880667  0.337303  1
  C  C132  1  0.085790  0.853252  0.363365  1
  C  C133  1  0.771871  0.147388  0.327549  1
  C  C134  1  0.438538  0.147388  0.327548  1
  C  C135  1  0.594795  0.109659  0.352625  1
  C  C136  1  0.105204  0.147388  0.327548  1
  C  C137  1  0.261460  0.109659  0.352625  1
  C  C138  1  0.605204  0.647387  0.327548  1
  C  C139  1  0.761461  0.609659  0.352625  1
  C  C140  1  0.928127  0.109659  0.352626  1
  C  C141  1  0.271871  0.647387  0.327549  1
  C  C142  1  0.428127  0.609658  0.352625  1
  C  C143  1  0.938538  0.647387  0.327548  1
  C  C144  1  0.094793  0.609659  0.352625  1
  C  C145  1  0.787075  0.109529  0.357405  1
  C  C146  1  0.453741  0.109529  0.357405  1
  C  C147  1  0.631792  0.131776  0.331239  1
  C  C148  1  0.120407  0.109529  0.357405  1
  C  C149  1  0.298458  0.131776  0.331238  1
  C  C150  1  0.620408  0.609529  0.357405  1
  C  C151  1  0.798458  0.631775  0.331239  1
  C  C152  1  0.965124  0.131777  0.331237  1
  C  C153  1  0.287074  0.609529  0.357405  1
  C  C154  1  0.465125  0.631776  0.331238  1
  C  C155  1  0.953741  0.609528  0.357405  1
  C  C156  1  0.131791  0.631778  0.331236  1
  C  C157  1  0.778692  0.347600  0.367702  1
  C  C158  1  0.445359  0.347599  0.367702  1
  C  C159  1  0.622589  0.377034  0.342332  1
  C  C160  1  0.112025  0.347601  0.367701  1
  C  C161  1  0.289257  0.377034  0.342332  1
  C  C162  1  0.612026  0.847599  0.367702  1
  C  C163  1  0.789257  0.877033  0.342332  1
  C  C164  1  0.955924  0.377034  0.342331  1
  C  C165  1  0.278691  0.847600  0.367701  1
  C  C166  1  0.455923  0.877034  0.342331  1
  C  C167  1  0.945360  0.847598  0.367702  1
  C  C168  1  0.122591  0.877034  0.342332  1
  C  C169  1  0.851730  0.402330  0.324937  1
  C  C170  1  0.518396  0.402330  0.324936  1
  C  C171  1  0.674572  0.366195  0.350256  1
  C  C172  1  0.185063  0.402330  0.324936  1
  C  C173  1  0.341240  0.366194  0.350256  1
  C  C174  1  0.685063  0.902330  0.324936  1
  C  C175  1  0.841240  0.866193  0.350255  1
  C  C176  1  0.007906  0.366194  0.350256  1
  C  C177  1  0.351729  0.902330  0.324936  1
  C  C178  1  0.507906  0.866194  0.350255  1
  C  C179  1  0.018397  0.902329  0.324937  1
  C  C180  1  0.174571  0.866194  0.350255  1
  C  C181  1  0.839297  0.097221  0.365805  1
  C  C182  1  0.505964  0.097221  0.365804  1
  C  C183  1  0.682871  0.125102  0.339820  1
  C  C184  1  0.172629  0.097221  0.365804  1
  C  C185  1  0.349537  0.125102  0.339819  1
  C  C186  1  0.672630  0.597221  0.365804  1
  C  C187  1  0.849537  0.625102  0.339820  1
  C  C188  1  0.016203  0.125102  0.339820  1
  C  C189  1  0.339297  0.597220  0.365804  1
  C  C190  1  0.516204  0.625102  0.339820  1
  C  C191  1  0.005964  0.597220  0.365804  1
  C  C192  1  0.182870  0.625102  0.339820  1
  C  C193  1  0.677823  0.031756  0.421879  1
  C  C194  1  0.344490  0.031756  0.421879  1
  C  C195  1  0.521596  0.061601  0.396029  1
  C  C196  1  0.011155  0.031756  0.421879  1
  C  C197  1  0.188262  0.061600  0.396029  1
  C  C198  1  0.511156  0.531756  0.421879  1
  C  C199  1  0.688263  0.561600  0.396029  1
  C  C200  1  0.854929  0.061600  0.396029  1
  C  C201  1  0.177822  0.531756  0.421879  1
  C  C202  1  0.354929  0.561600  0.396029  1
  C  C203  1  0.844489  0.531755  0.421879  1
  C  C204  1  0.021597  0.561599  0.396029  1
  C  C205  1  0.690240  0.331485  0.380723  1
  C  C206  1  0.356907  0.331485  0.380723  1
  C  C207  1  0.512865  0.302510  0.406234  1
  C  C208  1  0.023572  0.331487  0.380721  1
  C  C209  1  0.179533  0.302511  0.406234  1
  C  C210  1  0.523573  0.831486  0.380722  1
  C  C211  1  0.679533  0.802510  0.406234  1
  C  C212  1  0.846199  0.302512  0.406233  1
  C  C213  1  0.190239  0.831486  0.380722  1
  C  C214  1  0.346198  0.802511  0.406234  1
  C  C215  1  0.856906  0.831484  0.380723  1
  C  C216  1  0.012866  0.802510  0.406234  1
  C  C217  1  0.742128  0.322318  0.389144  1
  C  C218  1  0.408796  0.322317  0.389145  1
  C  C219  1  0.564890  0.291548  0.414748  1
  C  C220  1  0.075462  0.322318  0.389144  1
  C  C221  1  0.231557  0.291548  0.414748  1
  C  C222  1  0.575462  0.822318  0.389145  1
  C  C223  1  0.731558  0.791548  0.414748  1
  C  C224  1  0.898223  0.291550  0.414747  1
  C  C225  1  0.242128  0.822318  0.389144  1
  C  C226  1  0.398223  0.791549  0.414748  1
  C  C227  1  0.908797  0.822316  0.389145  1
  C  C228  1  0.064889  0.791548  0.414748  1
  C  C229  1  0.750812  0.083457  0.378750  1
  C  C230  1  0.417479  0.083457  0.378750  1
  C  C231  1  0.573588  0.051218  0.404511  1
  C  C232  1  0.084144  0.083457  0.378750  1
  C  C233  1  0.240253  0.051218  0.404511  1
  C  C234  1  0.584144  0.583457  0.378750  1
  C  C235  1  0.740254  0.551217  0.404511  1
  C  C236  1  0.906920  0.051219  0.404511  1
  C  C237  1  0.250812  0.583457  0.378750  1
  C  C238  1  0.406921  0.551218  0.404511  1
  C  C239  1  0.917479  0.583456  0.378750  1
  C  C240  1  0.073587  0.551217  0.404511  1
  C  C241  1  0.766244  0.047857  0.408896  1
  C  C242  1  0.432910  0.047858  0.408896  1
  C  C243  1  0.610414  0.075453  0.383172  1
  C  C244  1  0.099576  0.047857  0.408896  1
  C  C245  1  0.277080  0.075453  0.383172  1
  C  C246  1  0.599577  0.547857  0.408896  1
  C  C247  1  0.777080  0.575452  0.383172  1
  C  C248  1  0.943746  0.075453  0.383172  1
  C  C249  1  0.266243  0.547857  0.408896  1
  C  C250  1  0.443747  0.575452  0.383172  1
  C  C251  1  0.932910  0.547856  0.408896  1
  C  C252  1  0.110413  0.575452  0.383171  1
  C  C253  1  0.757779  0.286451  0.419212  1
  C  C254  1  0.424446  0.286450  0.419213  1
  C  C255  1  0.601478  0.317023  0.393488  1
  C  C256  1  0.091113  0.286452  0.419212  1
  C  C257  1  0.268146  0.317021  0.393489  1
  C  C258  1  0.591114  0.786451  0.419213  1
  C  C259  1  0.768146  0.817021  0.393488  1
  C  C260  1  0.934812  0.317024  0.393487  1
  C  C261  1  0.257778  0.786451  0.419212  1
  C  C262  1  0.434811  0.817022  0.393488  1
  C  C263  1  0.924446  0.786450  0.419213  1
  C  C264  1  0.101478  0.817022  0.393488  1
  C  C265  1  0.830690  0.338787  0.376202  1
  C  C266  1  0.497357  0.338786  0.376203  1
  C  C267  1  0.653485  0.306425  0.401935  1
  C  C268  1  0.164023  0.338786  0.376203  1
  C  C269  1  0.320152  0.306425  0.401936  1
  C  C270  1  0.664024  0.838786  0.376202  1
  C  C271  1  0.820153  0.806423  0.401936  1
  C  C272  1  0.986819  0.306425  0.401935  1
  C  C273  1  0.330690  0.838786  0.376202  1
  C  C274  1  0.486819  0.806425  0.401936  1
  C  C275  1  0.997357  0.838785  0.376203  1
  C  C276  1  0.153484  0.806425  0.401936  1
  C  C277  1  0.818252  0.037142  0.417444  1
  C  C278  1  0.484919  0.037142  0.417444  1
  C  C279  1  0.662289  0.066475  0.391622  1
  C  C280  1  0.151584  0.037142  0.417444  1
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  C  C863  1  0.857324  0.182931  0.726228  1
  C  C864  1  0.038070  0.183140  0.697412  1
