# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.87411762
_cell_length_b   14.71308811
_cell_length_c   46.98801245
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   74.49404683
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C324
_cell_volume   10574.9544309
_cell_formula_units_Z   324
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  0.675912  0.383730  0.304429  1
  C  C2  1  0.400765  0.292971  0.329491  1
  C  C3  1  0.342579  0.050397  0.304429  1
  C  C4  1  0.034334  0.345933  0.317113  1
  C  C5  1  0.067432  0.959637  0.329491  1
  C  C6  1  0.009245  0.717064  0.304429  1
  C  C7  1  0.701001  0.012600  0.317113  1
  C  C8  1  0.734098  0.626304  0.329491  1
  C  C9  1  0.367668  0.679266  0.317113  1
  C  C10  1  0.792633  0.026596  0.308638  1
  C  C11  1  0.424409  0.075566  0.295182  1
  C  C12  1  0.459300  0.693263  0.308638  1
  C  C13  1  0.164603  0.964078  0.316792  1
  C  C14  1  0.091075  0.742233  0.295182  1
  C  C15  1  0.125967  0.359929  0.308638  1
  C  C16  1  0.831270  0.630745  0.316792  1
  C  C17  1  0.757742  0.408900  0.295182  1
  C  C18  1  0.497937  0.297412  0.316792  1
  C  C19  1  0.852044  0.368497  0.310367  1
  C  C20  1  0.505959  0.314249  0.281994  1
  C  C21  1  0.518711  0.035163  0.310367  1
  C  C22  1  0.217313  0.321661  0.323587  1
  C  C23  1  0.172626  0.980916  0.281994  1
  C  C24  1  0.185378  0.701830  0.310367  1
  C  C25  1  0.883980  0.988328  0.323587  1
  C  C26  1  0.839292  0.647583  0.281994  1
  C  C27  1  0.550646  0.654994  0.323587  1
  C  C28  1  0.609617  0.051630  0.302227  1
  C  C29  1  0.336811  0.979753  0.329824  1
  C  C30  1  0.276284  0.718297  0.302227  1
  C  C31  1  0.976586  0.999233  0.314655  1
  C  C32  1  0.003478  0.646419  0.329824  1
  C  C33  1  0.942950  0.384963  0.302227  1
  C  C34  1  0.643252  0.665900  0.314655  1
  C  C35  1  0.670145  0.313086  0.329824  1
  C  C36  1  0.309919  0.332567  0.314655  1
  C  C37  1  0.762146  0.272723  0.348370  1
  C  C38  1  0.488791  0.199565  0.378841  1
  C  C39  1  0.428813  0.939389  0.348370  1
  C  C40  1  0.124653  0.238241  0.363995  1
  C  C41  1  0.155457  0.866232  0.378841  1
  C  C42  1  0.095480  0.606056  0.348370  1
  C  C43  1  0.791320  0.904908  0.363995  1
  C  C44  1  0.822124  0.532899  0.378841  1
  C  C45  1  0.457987  0.571574  0.363995  1
  C  C46  1  0.882861  0.924949  0.353597  1
  C  C47  1  0.518170  0.964346  0.338907  1
  C  C48  1  0.549528  0.591616  0.353597  1
  C  C49  1  0.247186  0.887413  0.367930  1
  C  C50  1  0.184836  0.631013  0.338907  1
  C  C51  1  0.216194  0.258282  0.353597  1
  C  C52  1  0.913853  0.554079  0.367930  1
  C  C53  1  0.851503  0.297680  0.338907  1
  C  C54  1  0.580520  0.220746  0.367930  1
  C  C55  1  0.942877  0.256954  0.356424  1
  C  C56  1  0.581537  0.277994  0.337845  1
  C  C57  1  0.609544  0.923621  0.356424  1
  C  C58  1  0.306754  0.218081  0.371322  1
  C  C59  1  0.248204  0.944661  0.337845  1
  C  C60  1  0.276211  0.590288  0.356424  1
  C  C61  1  0.973420  0.884747  0.371322  1
  C  C62  1  0.914870  0.611327  0.337845  1
  C  C63  1  0.640087  0.551414  0.371322  1
  C  C64  1  0.700410  0.945703  0.346382  1
  C  C65  1  0.427547  0.874891  0.376919  1
  C  C66  1  0.367077  0.612370  0.346382  1
  C  C67  1  0.065758  0.902827  0.360516  1
  C  C68  1  0.094214  0.541557  0.376919  1
  C  C69  1  0.033743  0.279037  0.346382  1
  C  C70  1  0.732425  0.569493  0.360516  1
  C  C71  1  0.760880  0.208224  0.376919  1
  C  C72  1  0.399091  0.236160  0.360516  1
  C  C73  1  0.851355  0.168963  0.395419  1
  C  C74  1  0.577930  0.100602  0.426889  1
  C  C75  1  0.518022  0.835630  0.395419  1
  C  C76  1  0.214407  0.135195  0.411398  1
  C  C77  1  0.244597  0.767268  0.426889  1
  C  C78  1  0.184689  0.502297  0.395419  1
  C  C79  1  0.881074  0.801861  0.411398  1
  C  C80  1  0.911263  0.433935  0.426889  1
  C  C81  1  0.547740  0.468528  0.411398  1
  C  C82  1  0.972466  0.823379  0.400854  1
  C  C83  1  0.608878  0.858844  0.385284  1
  C  C84  1  0.639133  0.490045  0.400854  1
  C  C85  1  0.335783  0.789480  0.416208  1
  C  C86  1  0.275545  0.525511  0.385284  1
  C  C87  1  0.305800  0.156712  0.400854  1
  C  C88  1  0.002450  0.456147  0.416208  1
  C  C89  1  0.942211  0.192177  0.385284  1
  C  C90  1  0.669116  0.122814  0.416208  1
  C  C91  1  0.032800  0.152490  0.403527  1
  C  C92  1  0.669947  0.184034  0.386911  1
  C  C93  1  0.699467  0.819156  0.403527  1
  C  C94  1  0.396255  0.117746  0.419143  1
  C  C95  1  0.336613  0.850701  0.386911  1
  C  C96  1  0.366134  0.485823  0.403527  1
  C  C97  1  0.062922  0.784413  0.419143  1
  C  C98  1  0.003280  0.517367  0.386911  1
  C  C99  1  0.729588  0.451079  0.419143  1
  C  C100  1  0.790569  0.841521  0.393167  1
  C  C101  1  0.517143  0.773137  0.424460  1
  C  C102  1  0.457236  0.508188  0.393167  1
  C  C103  1  0.154308  0.805957  0.408438  1
  C  C104  1  0.183809  0.439804  0.424460  1
  C  C105  1  0.123902  0.174854  0.393167  1
  C  C106  1  0.820975  0.472623  0.408438  1
  C  C107  1  0.850476  0.106471  0.424460  1
  C  C108  1  0.487642  0.139290  0.408438  1
  C  C109  1  0.940809  0.067312  0.442981  1
  C  C110  1  0.667288  0.999917  0.474597  1
  C  C111  1  0.607476  0.733979  0.442981  1
  C  C112  1  0.304074  0.033809  0.458954  1
  C  C113  1  0.333955  0.666583  0.474597  1
  C  C114  1  0.274142  0.400646  0.442981  1
  C  C115  1  0.970741  0.700476  0.458954  1
  C  C116  1  0.000621  0.333250  0.474597  1
  C  C117  1  0.637407  0.367143  0.458954  1
  C  C118  1  0.061929  0.722745  0.448366  1
  C  C119  1  0.698658  0.756546  0.432595  1
  C  C120  1  0.728596  0.389412  0.448366  1
  C  C121  1  0.425153  0.688899  0.464016  1
  C  C122  1  0.365325  0.423213  0.432595  1
  C  C123  1  0.395263  0.056078  0.448366  1
  C  C124  1  0.091820  0.355566  0.464016  1
  C  C125  1  0.031992  0.089880  0.432595  1
  C  C126  1  0.758487  0.022232  0.464016  1
  C  C127  1  0.122401  0.050630  0.451041  1
  C  C128  1  0.759237  0.083889  0.434831  1
  C  C129  1  0.789067  0.717297  0.451041  1
  C  C130  1  0.485755  0.016867  0.466764  1
  C  C131  1  0.425903  0.750555  0.434831  1
  C  C132  1  0.455734  0.383963  0.451041  1
  C  C133  1  0.152422  0.683534  0.466764  1
  C  C134  1  0.092570  0.417222  0.434831  1
  C  C135  1  0.819089  0.350200  0.466764  1
  C  C136  1  0.880258  0.739696  0.440558  1
  C  C137  1  0.606715  0.672082  0.472119  1
  C  C138  1  0.546924  0.406363  0.440558  1
  C  C139  1  0.243585  0.705792  0.456115  1
  C  C140  1  0.273381  0.338749  0.472119  1
  C  C141  1  0.213591  0.073029  0.440558  1
  C  C142  1  0.910252  0.372458  0.456115  1
  C  C143  1  0.940048  0.005415  0.472119  1
  C  C144  1  0.576918  0.039125  0.456115  1
  C  C145  1  0.030352  0.966282  0.490663  1
  C  C146  1  0.756792  0.898964  0.522231  1
  C  C147  1  0.697019  0.632949  0.490663  1
  C  C148  1  0.393622  0.932613  0.506505  1
  C  C149  1  0.423458  0.565631  0.522231  1
  C  C150  1  0.363686  0.299615  0.490663  1
  C  C151  1  0.060288  0.599279  0.506505  1
  C  C152  1  0.090125  0.232297  0.522231  1
  C  C153  1  0.726955  0.265946  0.506505  1
  C  C154  1  0.151421  0.621687  0.495895  1
  C  C155  1  0.788251  0.655336  0.480169  1
  C  C156  1  0.818088  0.288354  0.495895  1
  C  C157  1  0.514690  0.588018  0.511736  1
  C  C158  1  0.454918  0.322003  0.480169  1
  C  C159  1  0.484754  0.955020  0.495895  1
  C  C160  1  0.181357  0.254684  0.511736  1
  C  C161  1  0.121584  0.988669  0.480169  1
  C  C162  1  0.848024  0.921351  0.511736  1
  C  C163  1  0.211977  0.949479  0.498653  1
  C  C164  1  0.848755  0.983081  0.482574  1
  C  C165  1  0.878644  0.616145  0.498653  1
  C  C166  1  0.575238  0.915748  0.514320  1
  C  C167  1  0.515422  0.649747  0.482574  1
  C  C168  1  0.545311  0.282812  0.498653  1
  C  C169  1  0.241904  0.582415  0.514320  1
  C  C170  1  0.182089  0.316414  0.482574  1
  C  C171  1  0.908571  0.249082  0.514320  1
  C  C172  1  0.969805  0.638551  0.488079  1
  C  C173  1  0.696287  0.571219  0.519825  1
  C  C174  1  0.636472  0.305218  0.488079  1
  C  C175  1  0.333065  0.604821  0.503746  1
  C  C176  1  0.362954  0.237886  0.519825  1
  C  C177  1  0.303138  0.971885  0.488079  1
  C  C178  1  -0.000268  0.271488  0.503746  1
  C  C179  1  0.029621  0.904553  0.519825  1
  C  C180  1  0.666399  0.938155  0.503746  1
  C  C181  1  0.119889  0.865401  0.538383  1
  C  C182  1  0.846384  0.797754  0.569804  1
  C  C183  1  0.786556  0.532068  0.538383  1
  C  C184  1  0.483113  0.831555  0.554033  1
  C  C185  1  0.513051  0.464420  0.569804  1
  C  C186  1  0.453223  0.198734  0.538383  1
  C  C187  1  0.149780  0.498222  0.554033  1
  C  C188  1  0.179718  0.131087  0.569804  1
  C  C189  1  0.816447  0.164888  0.554033  1
  C  C190  1  0.240969  0.520491  0.543445  1
  C  C191  1  0.877755  0.554383  0.527803  1
  C  C192  1  0.907635  0.187157  0.543445  1
  C  C193  1  0.604234  0.486988  0.559418  1
  C  C194  1  0.544421  0.221050  0.527803  1
  C  C195  1  0.574302  0.853824  0.543445  1
  C  C196  1  0.270900  0.153654  0.559418  1
  C  C197  1  0.211088  0.887717  0.527803  1
  C  C198  1  0.937567  0.820321  0.559418  1
  C  C199  1  0.301458  0.848508  0.546284  1
  C  C200  1  0.938328  0.882218  0.530280  1
  C  C201  1  0.968124  0.515175  0.546284  1
  C  C202  1  0.664785  0.814604  0.561841  1
  C  C203  1  0.604995  0.548885  0.530280  1
  C  C204  1  0.634791  0.181841  0.546284  1
  C  C205  1  0.331452  0.481271  0.561841  1
  C  C206  1  0.271661  0.215551  0.530280  1
  C  C207  1  0.998118  0.147937  0.561841  1
  C  C208  1  0.059287  0.537433  0.535636  1
  C  C209  1  0.785806  0.470411  0.567569  1
  C  C210  1  0.725954  0.204100  0.535636  1
  C  C211  1  0.422642  0.503670  0.551359  1
  C  C212  1  0.452473  0.137078  0.567569  1
  C  C213  1  0.392621  0.870766  0.535636  1
  C  C214  1  0.089309  0.170336  0.551359  1
  C  C215  1  0.119139  0.803745  0.567569  1
  C  C216  1  0.755975  0.837003  0.551359  1
  C  C217  1  0.209260  0.764819  0.586191  1
  C  C218  1  0.936165  0.695456  0.617115  1
  C  C219  1  0.875926  0.431486  0.586191  1
  C  C220  1  0.572576  0.730921  0.601545  1
  C  C221  1  0.602831  0.362122  0.617115  1
  C  C222  1  0.542593  0.098153  0.586191  1
  C  C223  1  0.239243  0.397588  0.601545  1
  C  C224  1  0.269498  0.028789  0.617115  1
  C  C225  1  0.905910  0.064255  0.601545  1
  C  C226  1  0.330636  0.419105  0.591001  1
  C  C227  1  0.967113  0.453698  0.575510  1
  C  C228  1  0.997302  0.085772  0.591001  1
  C  C229  1  0.693687  0.385336  0.606981  1
  C  C230  1  0.633779  0.120365  0.575510  1
  C  C231  1  0.663969  0.752439  0.591001  1
  C  C232  1  0.360354  0.052003  0.606981  1
  C  C233  1  0.300446  0.787031  0.575510  1
  C  C234  1  0.027021  0.718670  0.606981  1
  C  C235  1  0.390734  0.748343  0.593961  1
  C  C236  1  0.027900  0.781162  0.577939  1
  C  C237  1  0.057401  0.415010  0.593961  1
  C  C238  1  0.754474  0.712779  0.609232  1
  C  C239  1  0.694567  0.447829  0.577939  1
  C  C240  1  0.724068  0.081677  0.593961  1
  C  C241  1  0.421140  0.379446  0.609232  1
  C  C242  1  0.361233  0.114496  0.577939  1
  C  C243  1  0.087807  0.046112  0.609232  1
  C  C244  1  0.148788  0.436554  0.583256  1
  C  C245  1  0.875096  0.370266  0.615488  1
  C  C246  1  0.815454  0.103221  0.583256  1
  C  C247  1  0.512242  0.401810  0.598873  1
  C  C248  1  0.541763  0.036933  0.615488  1
  C  C249  1  0.482121  0.769887  0.583256  1
  C  C250  1  0.178909  0.068477  0.598873  1
  C  C251  1  0.208429  0.703599  0.615488  1
  C  C252  1  0.845576  0.735143  0.598873  1
  C  C253  1  0.297856  0.666887  0.634469  1
  C  C254  1  0.026873  0.589953  0.663493  1
  C  C255  1  0.964523  0.333554  0.634469  1
  C  C256  1  0.662182  0.629351  0.648803  1
  C  C257  1  0.693540  0.256620  0.663493  1
  C  C258  1  0.631190  1.000220  0.634469  1
  C  C259  1  0.328848  0.296017  0.648803  1
  C  C260  1  0.360206  0.923287  0.663493  1
  C  C261  1  0.995515  0.962684  0.648803  1
  C  C262  1  0.420389  0.316059  0.638405  1
  C  C263  1  0.056252  0.354734  0.623559  1
  C  C264  1  0.087056  0.982726  0.638405  1
  C  C265  1  0.782896  0.281577  0.654029  1
  C  C266  1  0.722919  0.021401  0.623559  1
  C  C267  1  0.753723  0.649392  0.638405  1
  C  C268  1  0.449563  0.948244  0.654029  1
  C  C269  1  0.389585  0.688068  0.623559  1
  C  C270  1  0.116230  0.614910  0.654029  1
  C  C271  1  0.479285  0.651473  0.641883  1
  C  C272  1  0.117496  0.679409  0.625481  1
  C  C273  1  0.145951  0.318140  0.641883  1
  C  C274  1  0.844633  0.608597  0.656017  1
  C  C275  1  0.784162  0.346076  0.625481  1
  C  C276  1  0.812618  0.984806  0.641883  1
  C  C277  1  0.511300  0.275263  0.656017  1
  C  C278  1  0.450829  0.012742  0.625481  1
  C  C279  1  0.177966  0.941930  0.656017  1
  C  C280  1  0.238289  0.336219  0.631078  1
  C  C281  1  0.963506  0.276306  0.664554  1
  C  C282  1  0.904956  0.002886  0.631078  1
  C  C283  1  0.602165  0.297346  0.645976  1
  C  C284  1  0.630172  0.942973  0.664554  1
  C  C285  1  0.571622  0.669552  0.631078  1
  C  C286  1  0.268832  0.964012  0.645976  1
  C  C287  1  0.296839  0.609639  0.664554  1
  C  C288  1  0.935499  0.630679  0.645976  1
  C  C289  1  0.380440  0.590222  0.685607  1
  C  C290  1  0.120634  0.478733  0.707218  1
  C  C291  1  0.047106  0.256888  0.685607  1
  C  C292  1  0.752409  0.527704  0.693761  1
  C  C293  1  0.787301  0.145400  0.707218  1
  C  C294  1  0.713773  0.923555  0.685607  1
  C  C295  1  0.419076  0.194370  0.693761  1
  C  C296  1  0.453967  0.812067  0.707218  1
  C  C297  1  0.085742  0.861037  0.693761  1
  C  C298  1  0.510708  0.208367  0.685287  1
  C  C299  1  0.144277  0.261329  0.672908  1
  C  C300  1  0.177375  0.875034  0.685287  1
  C  C301  1  0.869131  0.170569  0.697970  1
  C  C302  1  0.810944  0.927996  0.672908  1
  C  C303  1  0.844042  0.541700  0.685287  1
  C  C304  1  0.535797  0.837236  0.697970  1
  C  C305  1  0.477611  0.594662  0.672908  1
  C  C306  1  0.202464  0.503903  0.697970  1
  C  C307  1  0.568457  0.555067  0.687744  1
  C  C308  1  0.208231  0.574547  0.672575  1
  C  C309  1  0.235124  0.221733  0.687744  1
  C  C310  1  0.935426  0.502670  0.700172  1
  C  C311  1  0.874898  0.241214  0.672575  1
  C  C312  1  0.901790  0.888400  0.687744  1
  C  C313  1  0.602092  0.169337  0.700172  1
  C  C314  1  0.541565  0.907880  0.672575  1
  C  C315  1  0.268759  0.836003  0.700172  1
  C  C316  1  0.327730  0.232639  0.678812  1
  C  C317  1  0.039084  0.240050  0.720405  1
  C  C318  1  0.994397  0.899306  0.678812  1
  C  C319  1  0.692998  0.185803  0.692033  1
  C  C320  1  0.705750  0.906717  0.720405  1
  C  C321  1  0.661063  0.565972  0.678812  1
  C  C322  1  0.359665  0.852470  0.692033  1
  C  C323  1  0.372417  0.573384  0.720405  1
  C  C324  1  0.026332  0.519136  0.692033  1
