# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.36748068
_cell_length_b   41.36924406
_cell_length_c   49.12915200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.72903718
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C864
_cell_volume   14972.719932
_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  0.537251  0.521162  0.332812  1
  C  C2  1  0.514757  0.189253  0.313672  1
  C  C3  1  0.500426  0.856427  0.297278  1
  C  C4  1  0.870584  0.187828  0.332812  1
  C  C5  1  0.848090  0.855920  0.313672  1
  C  C6  1  0.203918  0.854495  0.332812  1
  C  C7  1  0.833760  0.523094  0.297278  1
  C  C8  1  0.181424  0.522587  0.313672  1
  C  C9  1  0.167093  0.189761  0.297278  1
  C  C10  1  0.598615  0.355211  0.294613  1
  C  C11  1  0.648175  0.022845  0.328328  1
  C  C12  1  0.622049  0.689413  0.311359  1
  C  C13  1  0.931949  0.021878  0.294613  1
  C  C14  1  0.981508  0.689511  0.328328  1
  C  C15  1  0.265282  0.688544  0.294613  1
  C  C16  1  0.955382  0.356079  0.311359  1
  C  C17  1  0.314841  0.356178  0.328328  1
  C  C18  1  0.288715  0.022746  0.311359  1
  C  C19  1  0.478558  0.638158  0.282384  1
  C  C20  1  0.524144  0.300235  0.319936  1
  C  C21  1  0.497945  0.967375  0.303663  1
  C  C22  1  0.811892  0.304824  0.282384  1
  C  C23  1  0.857477  0.966902  0.319936  1
  C  C24  1  0.145225  0.971491  0.282384  1
  C  C25  1  0.831278  0.634041  0.303663  1
  C  C26  1  0.190811  0.633569  0.319936  1
  C  C27  1  0.164612  0.300708  0.303663  1
  C  C28  1  0.603605  0.427640  0.296843  1
  C  C29  1  0.575420  0.094486  0.276081  1
  C  C30  1  0.626302  0.759252  0.314232  1
  C  C31  1  0.936939  0.094307  0.296843  1
  C  C32  1  0.908754  0.761153  0.276081  1
  C  C33  1  0.270272  0.760974  0.296843  1
  C  C34  1  0.959635  0.425918  0.314232  1
  C  C35  1  0.242087  0.427819  0.276081  1
  C  C36  1  0.292968  0.092585  0.314232  1
  C  C37  1  0.610274  0.315880  0.291092  1
  C  C38  1  0.643540  0.980851  0.326805  1
  C  C39  1  0.621029  0.648074  0.307538  1
  C  C40  1  0.943607  0.982547  0.291092  1
  C  C41  1  0.976873  0.647518  0.326805  1
  C  C42  1  0.276940  0.649213  0.291092  1
  C  C43  1  0.954362  0.314741  0.307538  1
  C  C44  1  0.310207  0.314185  0.326805  1
  C  C45  1  0.287695  0.981407  0.307538  1
  C  C46  1  0.421063  0.408062  0.286303  1
  C  C47  1  0.379481  0.080526  0.284951  1
  C  C48  1  0.408989  0.744878  0.319829  1
  C  C49  1  0.754397  0.074729  0.286303  1
  C  C50  1  0.712814  0.747192  0.284951  1
  C  C51  1  0.087730  0.741396  0.286303  1
  C  C52  1  0.742322  0.411545  0.319829  1
  C  C53  1  0.046147  0.413859  0.284951  1
  C  C54  1  0.075656  0.078212  0.319829  1
  C  C55  1  0.535991  0.479823  0.330028  1
  C  C56  1  0.510157  0.148366  0.311392  1
  C  C57  1  0.481911  0.817230  0.295102  1
  C  C58  1  0.869324  0.146489  0.330028  1
  C  C59  1  0.843491  0.815033  0.311392  1
  C  C60  1  0.202657  0.813156  0.330028  1
  C  C61  1  0.815245  0.483897  0.295102  1
  C  C62  1  0.176824  0.481699  0.311392  1
  C  C63  1  0.148578  0.150564  0.295102  1
  C  C64  1  0.617172  0.466812  0.300206  1
  C  C65  1  0.571737  0.135453  0.278918  1
  C  C66  1  0.629833  0.800841  0.317010  1
  C  C67  1  0.950506  0.133479  0.300206  1
  C  C68  1  0.905070  0.802120  0.278918  1
  C  C69  1  0.283839  0.800145  0.300206  1
  C  C70  1  0.963166  0.467508  0.317010  1
  C  C71  1  0.238404  0.468787  0.278918  1
  C  C72  1  0.296500  0.134175  0.317010  1
  C  C73  1  0.391675  0.538008  0.311313  1
  C  C74  1  0.366298  0.206382  0.292051  1
  C  C75  1  0.420139  0.869493  0.327206  1
  C  C76  1  0.725009  0.204675  0.311313  1
  C  C77  1  0.699631  0.873049  0.292051  1
  C  C78  1  0.058342  0.871342  0.311313  1
  C  C79  1  0.753473  0.536160  0.327206  1
  C  C80  1  0.032964  0.539715  0.292051  1
  C  C81  1  0.086806  0.202827  0.327206  1
  C  C82  1  0.534834  0.620490  0.253189  1
  C  C83  1  0.520364  0.258740  0.317833  1
  C  C84  1  0.508148  0.928350  0.301404  1
  C  C85  1  0.868167  0.287157  0.253189  1
  C  C86  1  0.853698  0.925406  0.317833  1
  C  C87  1  0.201501  0.953824  0.253189  1
  C  C88  1  0.841481  0.595016  0.301404  1
  C  C89  1  0.187031  0.592073  0.317833  1
  C  C90  1  0.174815  0.261683  0.301404  1
  C  C91  1  0.402692  0.371631  0.299685  1
  C  C92  1  0.340937  0.040647  0.279995  1
  C  C93  1  0.410823  0.702983  0.318077  1
  C  C94  1  0.736026  0.038298  0.299685  1
  C  C95  1  0.674271  0.707314  0.279995  1
  C  C96  1  0.069359  0.704965  0.299685  1
  C  C97  1  0.744156  0.369650  0.318077  1
  C  C98  1  0.007604  0.373981  0.279995  1
  C  C99  1  0.077489  0.036316  0.318077  1
  C  C100  1  0.393963  0.576815  0.313894  1
  C  C101  1  0.370785  0.245540  0.294291  1
  C  C102  1  0.423782  0.910680  0.329578  1
  C  C103  1  0.727296  0.243482  0.313894  1
  C  C104  1  0.704119  0.912206  0.294291  1
  C  C105  1  0.060629  0.910148  0.313894  1
  C  C106  1  0.757115  0.577347  0.329578  1
  C  C107  1  0.037452  0.578873  0.294291  1
  C  C108  1  0.090448  0.244014  0.329578  1
  C  C109  1  0.608058  0.517094  0.388313  1
  C  C110  1  0.583803  0.185519  0.369897  1
  C  C111  1  0.561807  0.853281  0.351519  1
  C  C112  1  0.941391  0.183761  0.388313  1
  C  C113  1  0.917136  0.852186  0.369897  1
  C  C114  1  0.274724  0.850427  0.388313  1
  C  C115  1  0.895140  0.519948  0.351519  1
  C  C116  1  0.250470  0.518853  0.369897  1
  C  C117  1  0.228474  0.186614  0.351519  1
  C  C118  1  0.668005  0.353456  0.348414  1
  C  C119  1  0.715687  0.017542  0.384652  1
  C  C120  1  0.693088  0.685572  0.366214  1
  C  C121  1  0.001338  0.020122  0.348414  1
  C  C122  1  0.049021  0.684209  0.384652  1
  C  C123  1  0.334671  0.686789  0.348414  1
  C  C124  1  0.026422  0.352238  0.366214  1
  C  C125  1  0.382354  0.350875  0.384652  1
  C  C126  1  0.359755  0.018905  0.366214  1
  C  C127  1  0.545017  0.632195  0.338991  1
  C  C128  1  0.592512  0.295892  0.375823  1
  C  C129  1  0.570179  0.964254  0.357111  1
  C  C130  1  0.878350  0.298861  0.338991  1
  C  C131  1  0.925845  0.962558  0.375823  1
  C  C132  1  0.211683  0.965528  0.338991  1
  C  C133  1  0.903512  0.630921  0.357111  1
  C  C134  1  0.259178  0.629225  0.375823  1
  C  C135  1  0.236846  0.297587  0.357111  1
  C  C136  1  0.674650  0.423130  0.351639  1
  C  C137  1  0.636808  0.093018  0.338833  1
  C  C138  1  0.693978  0.755095  0.371066  1
  C  C139  1  0.007983  0.089796  0.351639  1
  C  C140  1  0.970141  0.759685  0.338833  1
  C  C141  1  0.341316  0.756463  0.351639  1
  C  C142  1  0.027311  0.421761  0.371066  1
  C  C143  1  0.303475  0.426351  0.338833  1
  C  C144  1  0.360645  0.088428  0.371066  1
  C  C145  1  0.667240  0.312143  0.345774  1
  C  C146  1  0.712524  0.976192  0.382497  1
  C  C147  1  0.689477  0.644221  0.363891  1
  C  C148  1  0.000574  0.978810  0.345774  1
  C  C149  1  0.045857  0.642858  0.382497  1
  C  C150  1  0.333907  0.645476  0.345774  1
  C  C151  1  0.022811  0.310888  0.363891  1
  C  C152  1  0.379191  0.309525  0.382497  1
  C  C153  1  0.356144  0.977555  0.363891  1
  C  C154  1  0.458309  0.408576  0.357722  1
  C  C155  1  0.432221  0.076626  0.339292  1
  C  C156  1  0.479772  0.740393  0.375711  1
  C  C157  1  0.791642  0.075242  0.357722  1
  C  C158  1  0.765554  0.743292  0.339292  1
  C  C159  1  0.124975  0.741909  0.357722  1
  C  C160  1  0.813106  0.407060  0.375711  1
  C  C161  1  0.098888  0.409959  0.339292  1
  C  C162  1  0.146439  0.073726  0.375711  1
  C  C163  1  0.604893  0.475893  0.385819  1
  C  C164  1  0.579971  0.144509  0.367981  1
  C  C165  1  0.558207  0.812192  0.349057  1
  C  C166  1  0.938226  0.142559  0.385819  1
  C  C167  1  0.913304  0.811176  0.367981  1
  C  C168  1  0.271560  0.809226  0.385819  1
  C  C169  1  0.891540  0.478858  0.349057  1
  C  C170  1  0.246637  0.477843  0.367981  1
  C  C171  1  0.224874  0.145525  0.349057  1
  C  C172  1  0.677182  0.464176  0.354319  1
  C  C173  1  0.649465  0.132799  0.335782  1
  C  C174  1  0.698843  0.796405  0.372968  1
  C  C175  1  0.010515  0.130842  0.354319  1
  C  C176  1  0.982799  0.799466  0.335782  1
  C  C177  1  0.343848  0.797509  0.354319  1
  C  C178  1  0.032176  0.463072  0.372968  1
  C  C179  1  0.316132  0.466133  0.335782  1
  C  C180  1  0.365509  0.129738  0.372968  1
  C  C181  1  0.466965  0.533312  0.364720  1
  C  C182  1  0.440766  0.201539  0.346565  1
  C  C183  1  0.489679  0.865216  0.382999  1
  C  C184  1  0.800298  0.199979  0.364720  1
  C  C185  1  0.774099  0.868206  0.346565  1
  C  C186  1  0.133631  0.866645  0.364720  1
  C  C187  1  0.823012  0.531882  0.382999  1
  C  C188  1  0.107432  0.534873  0.346565  1
  C  C189  1  0.156346  0.198549  0.382999  1
  C  C190  1  0.541950  0.591203  0.336707  1
  C  C191  1  0.589433  0.254646  0.373739  1
  C  C192  1  0.566615  0.923083  0.355328  1
  C  C193  1  0.875283  0.257870  0.336707  1
  C  C194  1  0.922766  0.921312  0.373739  1
  C  C195  1  0.208617  0.924536  0.336707  1
  C  C196  1  0.899949  0.589750  0.355328  1
  C  C197  1  0.256100  0.587979  0.373739  1
  C  C198  1  0.233282  0.256417  0.355328  1
  C  C199  1  0.455411  0.366928  0.354660  1
  C  C200  1  0.432619  0.034918  0.335992  1
  C  C201  1  0.479941  0.698941  0.373394  1
  C  C202  1  0.788744  0.033595  0.354660  1
  C  C203  1  0.765952  0.701585  0.335992  1
  C  C204  1  0.122077  0.700262  0.354660  1
  C  C205  1  0.813274  0.365608  0.373394  1
  C  C206  1  0.099286  0.368252  0.335992  1
  C  C207  1  0.146607  0.032275  0.373394  1
  C  C208  1  0.469168  0.574191  0.367148  1
  C  C209  1  0.444170  0.242096  0.348842  1
  C  C210  1  0.492941  0.906392  0.385231  1
  C  C211  1  0.802502  0.240858  0.367148  1
  C  C212  1  0.777503  0.908763  0.348842  1
  C  C213  1  0.135835  0.907525  0.367148  1
  C  C214  1  0.826274  0.573059  0.385231  1
  C  C215  1  0.110837  0.575430  0.348842  1
  C  C216  1  0.159607  0.239726  0.385231  1
  C  C217  1  0.678661  0.512891  0.443695  1
  C  C218  1  0.655269  0.181060  0.425316  1
  C  C219  1  0.631148  0.849183  0.406862  1
  C  C220  1  0.011994  0.179558  0.443695  1
  C  C221  1  0.988602  0.847727  0.425316  1
  C  C222  1  0.345328  0.846224  0.443695  1
  C  C223  1  0.964482  0.515850  0.406862  1
  C  C224  1  0.321936  0.514394  0.425316  1
  C  C225  1  0.297815  0.182517  0.406862  1
  C  C226  1  0.739112  0.349297  0.403407  1
  C  C227  1  0.786370  0.013116  0.440265  1
  C  C228  1  0.762906  0.681290  0.421741  1
  C  C229  1  0.072446  0.015964  0.403407  1
  C  C230  1  0.119703  0.679782  0.440265  1
  C  C231  1  0.405779  0.682631  0.403407  1
  C  C232  1  0.096240  0.347956  0.421741  1
  C  C233  1  0.453037  0.346449  0.440265  1
  C  C234  1  0.429573  0.014623  0.421741  1
  C  C235  1  0.616392  0.627991  0.394159  1
  C  C236  1  0.663344  0.291725  0.431219  1
  C  C237  1  0.639698  0.959881  0.412654  1
  C  C238  1  0.949726  0.294658  0.394159  1
  C  C239  1  0.996677  0.958392  0.431219  1
  C  C240  1  0.283059  0.961325  0.394159  1
  C  C241  1  0.973031  0.626547  0.412654  1
  C  C242  1  0.330010  0.625058  0.431219  1
  C  C243  1  0.306364  0.293214  0.412654  1
  C  C244  1  0.743533  0.418771  0.407428  1
  C  C245  1  0.719187  0.087032  0.389676  1
  C  C246  1  0.766913  0.750699  0.426041  1
  C  C247  1  0.076867  0.085438  0.407428  1
  C  C248  1  0.052520  0.753698  0.389676  1
  C  C249  1  0.410200  0.752104  0.407428  1
  C  C250  1  0.100246  0.417366  0.426041  1
  C  C251  1  0.385854  0.420365  0.389676  1
  C  C252  1  0.433579  0.084033  0.426041  1
  C  C253  1  0.736603  0.308031  0.401130  1
  C  C254  1  0.783312  0.971878  0.438076  1
  C  C255  1  0.759738  0.640041  0.419544  1
  C  C256  1  0.069936  0.974698  0.401130  1
  C  C257  1  0.116646  0.638544  0.438076  1
  C  C258  1  0.403270  0.641364  0.401130  1
  C  C259  1  0.093072  0.306708  0.419544  1
  C  C260  1  0.449979  0.305211  0.438076  1
  C  C261  1  0.426405  0.973375  0.419544  1
  C  C262  1  0.528704  0.404050  0.412870  1
  C  C263  1  0.504497  0.072292  0.394482  1
  C  C264  1  0.551791  0.736043  0.431180  1
  C  C265  1  0.862038  0.070717  0.412870  1
  C  C266  1  0.837831  0.738959  0.394482  1
  C  C267  1  0.195371  0.737383  0.412870  1
  C  C268  1  0.885124  0.402710  0.431180  1
  C  C269  1  0.171164  0.405625  0.394482  1
  C  C270  1  0.218457  0.069376  0.431180  1
  C  C271  1  0.675658  0.471683  0.441340  1
  C  C272  1  0.651827  0.139858  0.423050  1
  C  C273  1  0.627703  0.807989  0.404631  1
  C  C274  1  0.008992  0.138349  0.441340  1
  C  C275  1  0.985161  0.806525  0.423050  1
  C  C276  1  0.342325  0.805016  0.441340  1
  C  C277  1  0.961036  0.474655  0.404631  1
  C  C278  1  0.318494  0.473191  0.423050  1
  C  C279  1  0.294369  0.141322  0.404631  1
  C  C280  1  0.745978  0.459968  0.409723  1
  C  C281  1  0.722519  0.128248  0.391397  1
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