# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.86898471
_cell_length_b   8.86229714
_cell_length_c   47.93107874
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.46304097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C224
_cell_volume   3691.24637563
_cell_formula_units_Z   224
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  0.898028  0.939938  0.335187  1
  C  C2  1  0.439626  0.398308  0.335192  1
  C  C3  1  0.510649  0.010946  0.296098  1
  C  C4  1  0.019198  0.519518  0.295828  1
  C  C5  1  0.125032  0.832541  0.306844  1
  C  C6  1  0.569773  0.315455  0.312074  1
  C  C7  1  0.673515  0.928541  0.277596  1
  C  C8  1  0.181173  0.430878  0.277999  1
  C  C9  1  0.740818  0.740026  0.277531  1
  C  C10  1  0.239793  0.241105  0.277518  1
  C  C11  1  0.359585  0.859827  0.259533  1
  C  C12  1  0.667955  0.168271  0.332032  1
  C  C13  1  0.815072  0.070125  0.312071  1
  C  C14  1  0.332212  0.625321  0.306849  1
  C  C15  1  0.428194  0.173899  0.277598  1
  C  C16  1  0.930481  0.681595  0.278011  1
  C  C17  1  0.039876  0.799823  0.279814  1
  C  C18  1  0.537329  0.291073  0.280434  1
  C  C19  1  0.474691  0.724114  0.311982  1
  C  C20  1  0.001559  0.245736  0.313554  1
  C  C21  1  0.142276  0.140355  0.296074  1
  C  C22  1  0.640083  0.642477  0.296083  1
  C  C23  1  0.544508  0.044761  0.330555  1
  C  C24  1  0.058227  0.558507  0.330024  1
  C  C25  1  0.790597  0.037765  0.280431  1
  C  C26  1  0.299380  0.540281  0.279807  1
  C  C27  1  0.223995  0.974925  0.311984  1
  C  C28  1  0.745571  0.501739  0.313554  1
  C  C29  1  0.802176  0.803298  0.336899  1
  C  C30  1  0.303025  0.302459  0.336897  1
  C  C31  1  0.389515  0.889731  0.295042  1
  C  C32  1  0.898250  0.398465  0.298833  1
  C  C33  1  0.761570  0.761105  0.398384  1
  C  C34  1  0.260996  0.261674  0.398384  1
  C  C35  1  0.342155  0.842286  0.363805  1
  C  C36  1  0.842452  0.342591  0.364403  1
  C  C37  1  0.930821  0.678443  0.382411  1
  C  C38  1  0.427751  0.176393  0.382455  1
  C  C39  1  0.506333  0.755838  0.347075  1
  C  C40  1  0.011482  0.263639  0.348149  1
  C  C41  1  0.595327  0.595933  0.364360  1
  C  C42  1  0.095783  0.095459  0.364360  1
  C  C43  1  0.181528  0.681784  0.329069  1
  C  C44  1  0.508902  0.008996  0.398573  1
  C  C45  1  0.676227  0.927920  0.382453  1
  C  C46  1  0.178265  0.430989  0.382411  1
  C  C47  1  0.255661  0.006543  0.347079  1
  C  C48  1  0.763442  0.511685  0.348149  1
  C  C49  1  0.895205  0.633741  0.348494  1
  C  C50  1  0.382827  0.127573  0.348789  1
  C  C51  1  0.300528  0.556532  0.381427  1
  C  C52  1  0.797933  0.054084  0.382336  1
  C  C53  1  0.969090  0.972499  0.366206  1
  C  C54  1  0.472295  0.469309  0.366214  1
  C  C55  1  0.384155  0.884275  0.397645  1
  C  C56  1  0.885140  0.385266  0.397882  1
  C  C57  1  0.627366  0.883012  0.348787  1
  C  C58  1  0.133536  0.395408  0.348494  1
  C  C59  1  0.056379  0.800689  0.381422  1
  C  C60  1  0.553942  0.298071  0.382338  1
  C  C61  1  0.636862  0.636653  0.398005  1
  C  C62  1  0.136523  0.136985  0.398005  1
  C  C63  1  0.218179  0.718381  0.363571  1
  C  C64  1  0.718114  0.218325  0.364825  1
  C  C65  1  0.595811  0.596186  0.464657  1
  C  C66  1  0.096211  0.095785  0.464656  1
  C  C67  1  0.178593  0.678644  0.431542  1
  C  C68  1  0.677994  0.178029  0.431871  1
  C  C69  1  0.762269  0.512370  0.448133  1
  C  C70  1  0.262183  0.012195  0.448018  1
  C  C71  1  0.344938  0.595973  0.414861  1
  C  C72  1  0.845370  0.095723  0.415389  1
  C  C73  1  0.427890  0.429485  0.431569  1
  C  C74  1  0.929445  0.927933  0.431568  1
  C  C75  1  0.010083  0.510189  0.398601  1
  C  C76  1  0.346053  0.846029  0.464611  1
  C  C77  1  0.512159  0.762221  0.448018  1
  C  C78  1  0.012332  0.262305  0.448132  1
  C  C79  1  0.095864  0.845044  0.414858  1
  C  C80  1  0.595621  0.345474  0.415392  1
  C  C81  1  0.720230  0.470457  0.414622  1
  C  C82  1  0.220266  0.970017  0.414450  1
  C  C83  1  0.137021  0.386860  0.448301  1
  C  C84  1  0.637015  0.886538  0.448257  1
  C  C85  1  0.804360  0.804065  0.431812  1
  C  C86  1  0.303991  0.304432  0.431813  1
  C  C87  1  0.221421  0.721431  0.464933  1
  C  C88  1  0.721445  0.221451  0.465157  1
  C  C89  1  0.469955  0.720332  0.414451  1
  C  C90  1  0.970390  0.220294  0.414621  1
  C  C91  1  0.886851  0.637031  0.448301  1
  C  C92  1  0.386531  0.137021  0.448257  1
  C  C93  1  0.471135  0.471603  0.464950  1
  C  C94  1  0.971594  0.971143  0.464949  1
  C  C95  1  0.053990  0.554064  0.431965  1
  C  C96  1  0.553537  0.053607  0.432026  1
  C  C97  1  0.430415  0.430452  0.531377  1
  C  C98  1  0.930602  0.930265  0.531377  1
  C  C99  1  0.013141  0.513054  0.498177  1
  C  C100  1  0.513064  0.012978  0.498111  1
  C  C101  1  0.597237  0.347349  0.514876  1
  C  C102  1  0.097444  0.847210  0.514877  1
  C  C103  1  0.179953  0.429950  0.481697  1
  C  C104  1  0.679964  0.929796  0.481661  1
  C  C105  1  0.263062  0.262960  0.498152  1
  C  C106  1  0.763047  0.762976  0.498152  1
  C  C107  1  0.846106  0.346080  0.464719  1
  C  C108  1  0.180574  0.680424  0.531410  1
  C  C109  1  0.347297  0.597356  0.514878  1
  C  C110  1  0.847437  0.097149  0.514876  1
  C  C111  1  0.929974  0.679930  0.481697  1
  C  C112  1  0.429819  0.179940  0.481661  1
  C  C113  1  0.554147  0.304736  0.481504  1
  C  C114  1  0.054717  0.804368  0.481483  1
  C  C115  1  0.972077  0.221743  0.514667  1
  C  C116  1  0.471875  0.721970  0.514673  1
  C  C117  1  0.638331  0.638489  0.498121  1
  C  C118  1  0.138545  0.138275  0.498120  1
  C  C119  1  0.055958  0.555838  0.531581  1
  C  C120  1  0.555850  0.055733  0.531524  1
  C  C121  1  0.304421  0.554664  0.481484  1
  C  C122  1  0.804794  0.054090  0.481504  1
  C  C123  1  0.721863  0.471958  0.514667  1
  C  C124  1  0.222088  0.971757  0.514673  1
  C  C125  1  0.305937  0.305737  0.531559  1
  C  C126  1  0.805856  0.805819  0.531559  1
  C  C127  1  0.888521  0.388464  0.498164  1
  C  C128  1  0.388473  0.888418  0.498090  1
  C  C129  1  0.265257  0.264912  0.598009  1
  C  C130  1  0.765188  0.764978  0.598007  1
  C  C131  1  0.847898  0.347686  0.564538  1
  C  C132  1  0.348033  0.847822  0.564704  1
  C  C133  1  0.431866  0.181496  0.581492  1
  C  C134  1  0.931810  0.681806  0.581487  1
  C  C135  1  0.014734  0.264317  0.548090  1
  C  C136  1  0.514456  0.764535  0.548115  1
  C  C137  1  0.098062  0.097637  0.564627  1
  C  C138  1  0.597849  0.597850  0.564627  1
  C  C139  1  0.680456  0.180305  0.531332  1
  C  C140  1  0.015308  0.515027  0.597964  1
  C  C141  1  0.182024  0.431591  0.581487  1
  C  C142  1  0.681708  0.931655  0.581491  1
  C  C143  1  0.764468  0.514584  0.548090  1
  C  C144  1  0.264683  0.014308  0.548115  1
  C  C145  1  0.389218  0.138937  0.548058  1
  C  C146  1  0.889187  0.639084  0.548071  1
  C  C147  1  0.806376  0.056186  0.581213  1
  C  C148  1  0.306596  0.556332  0.581290  1
  C  C149  1  0.473358  0.473163  0.564764  1
  C  C150  1  0.973347  0.973175  0.564764  1
  C  C151  1  0.890638  0.390399  0.597953  1
  C  C152  1  0.390811  0.890574  0.598129  1
  C  C153  1  0.139266  0.389004  0.548071  1
  C  C154  1  0.639117  0.889037  0.548057  1
  C  C155  1  0.556433  0.306129  0.581214  1
  C  C156  1  0.056579  0.806349  0.581290  1
  C  C157  1  0.140821  0.140218  0.598058  1
  C  C158  1  0.640455  0.640581  0.598058  1
  C  C159  1  0.723263  0.223081  0.564716  1
  C  C160  1  0.223448  0.723264  0.564795  1
  C  C161  1  0.099149  0.097881  0.664311  1
  C  C162  1  0.598242  0.598787  0.664310  1
  C  C163  1  0.682510  0.182165  0.631038  1
  C  C164  1  0.182178  0.681830  0.631029  1
  C  C165  1  0.268049  0.017344  0.648029  1
  C  C166  1  0.768020  0.516444  0.647822  1
  C  C167  1  0.848908  0.099424  0.614606  1
  C  C168  1  0.349789  0.599285  0.614623  1
  C  C169  1  0.932116  0.931686  0.631024  1
  C  C170  1  0.432031  0.431768  0.631025  1
  C  C171  1  0.515333  0.015057  0.598062  1
  C  C172  1  0.851472  0.351106  0.663996  1
  C  C173  1  0.016751  0.267715  0.647822  1
  C  C174  1  0.517642  0.767749  0.648029  1
  C  C175  1  0.599704  0.348627  0.614606  1
  C  C176  1  0.099568  0.849507  0.614623  1
  C  C177  1  0.224350  0.973827  0.614723  1
  C  C178  1  0.723880  0.473639  0.614414  1
  C  C179  1  0.641254  0.891140  0.648077  1
  C  C180  1  0.141526  0.391183  0.648081  1
  C  C181  1  0.307346  0.306954  0.631525  1
  C  C182  1  0.807275  0.807028  0.631522  1
  C  C183  1  0.727405  0.227029  0.664570  1
  C  C184  1  0.223106  0.722719  0.664437  1
  C  C185  1  0.973940  0.223580  0.614413  1
  C  C186  1  0.474126  0.724050  0.614723  1
  C  C187  1  0.391528  0.140868  0.648078  1
  C  C188  1  0.891569  0.641136  0.648076  1
  C  C189  1  0.972859  0.973954  0.664390  1
  C  C190  1  0.474332  0.472478  0.664391  1
  C  C191  1  0.558158  0.057839  0.631536  1
  C  C192  1  0.057400  0.557066  0.631445  1
  C  C193  1  0.930350  0.930028  0.732534  1
  C  C194  1  0.430564  0.429855  0.732530  1
  C  C195  1  0.541588  0.041029  0.700090  1
  C  C196  1  0.016540  0.515992  0.699015  1
  C  C197  1  0.086482  0.857610  0.714682  1
  C  C198  1  0.602847  0.348705  0.716345  1
  C  C199  1  0.689489  0.938812  0.681338  1
  C  C200  1  0.180221  0.436230  0.681843  1
  C  C201  1  0.791558  0.789557  0.700012  1
  C  C202  1  0.290102  0.291007  0.700010  1
  C  C203  1  0.348447  0.848090  0.664627  1
  C  C204  1  0.682332  0.181841  0.732533  1
  C  C205  1  0.849111  0.102391  0.716348  1
  C  C206  1  0.358077  0.586066  0.714678  1
  C  C207  1  0.439319  0.188982  0.681339  1
  C  C208  1  0.936725  0.679737  0.681836  1
  C  C209  1  0.059904  0.807663  0.681805  1
  C  C210  1  0.563635  0.312896  0.681364  1
  C  C211  1  0.466430  0.715235  0.715066  1
  C  C212  1  0.969026  0.222521  0.713763  1
  C  C213  1  0.117283  0.118952  0.698749  1
  C  C214  1  0.619259  0.617004  0.698747  1
  C  C215  1  0.568752  0.068151  0.731690  1
  C  C216  1  0.039838  0.539208  0.734681  1
  C  C217  1  0.813336  0.063195  0.681364  1
  C  C218  1  0.308100  0.559451  0.681806  1
  C  C219  1  0.215532  0.966068  0.715071  1
  C  C220  1  0.722897  0.468698  0.713755  1
  C  C221  1  0.817516  0.814919  0.731668  1
  C  C222  1  0.315539  0.316938  0.731665  1
  C  C223  1  0.365630  0.865368  0.699034  1
  C  C224  1  0.891735  0.391434  0.698756  1
