# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.79020608
_cell_length_b   41.72954841
_cell_length_c   47.80023056
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   88.07083648
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C324
_cell_volume   5562.41944079
_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  0.201745  0.093584  0.317957  1
  C  C2  1  0.536842  0.423194  0.285069  1
  C  C3  1  0.368013  0.760931  0.301642  1
  C  C4  1  0.628172  0.240355  0.308506  1
  C  C5  1  0.456165  0.584578  0.325226  1
  C  C6  1  0.782902  0.931835  0.293912  1
  C  C7  1  0.257142  0.983110  0.312402  1
  C  C8  1  0.590973  0.315503  0.280356  1
  C  C9  1  0.421859  0.653736  0.294762  1
  C  C10  1  0.660802  0.175336  0.279968  1
  C  C11  1  0.485648  0.525902  0.322657  1
  C  C12  1  0.821605  0.853320  0.288713  1
  C  C13  1  0.597097  0.303270  0.311240  1
  C  C14  1  0.427721  0.641995  0.325750  1
  C  C15  1  0.764217  0.969055  0.296233  1
  C  C16  1  0.150403  0.195997  0.276510  1
  C  C17  1  0.980425  0.536278  0.307186  1
  C  C18  1  0.817696  0.861184  0.320649  1
  C  C19  1  0.180699  0.135605  0.320147  1
  C  C20  1  0.518057  0.460576  0.286182  1
  C  C21  1  0.348263  0.800289  0.300674  1
  C  C22  1  0.673839  0.149237  0.305251  1
  C  C23  1  0.513981  0.468753  0.318042  1
  C  C24  1  0.840258  0.816193  0.285696  1
  C  C25  1  0.202493  0.092163  0.282061  1
  C  C26  1  0.044574  0.407836  0.300115  1
  C  C27  1  0.875473  0.746111  0.315182  1
  C  C28  1  0.236718  0.023843  0.314144  1
  C  C29  1  0.572209  0.352840  0.282145  1
  C  C30  1  0.403074  0.691135  0.297062  1
  C  C31  1  0.132854  0.231050  0.292587  1
  C  C32  1  0.960460  0.576046  0.308932  1
  C  C33  1  0.788880  0.919829  0.324893  1
  C  C34  1  0.233809  0.029557  0.277764  1
  C  C35  1  0.065119  0.366925  0.298129  1
  C  C36  1  0.896424  0.704346  0.313361  1
  C  C37  1  0.704351  0.088403  0.367718  1
  C  C38  1  0.038764  0.419413  0.334890  1
  C  C39  1  0.869969  0.757055  0.350984  1
  C  C40  1  0.120842  0.255308  0.361577  1
  C  C41  1  0.954434  0.588177  0.375611  1
  C  C42  1  0.285447  0.926632  0.344044  1
  C  C43  1  0.758697  0.979930  0.363171  1
  C  C44  1  0.092941  0.311514  0.329974  1
  C  C45  1  0.924647  0.648087  0.345123  1
  C  C46  1  0.155944  0.185178  0.358943  1
  C  C47  1  0.990361  0.516383  0.372477  1
  C  C48  1  0.322255  0.852146  0.339232  1
  C  C49  1  0.100941  0.295319  0.363332  1
  C  C50  1  0.934044  0.629138  0.376989  1
  C  C51  1  0.264805  0.967791  0.345951  1
  C  C52  1  0.647789  0.201387  0.346883  1
  C  C53  1  0.482393  0.532255  0.357066  1
  C  C54  1  0.315059  0.866798  0.373234  1
  C  C55  1  0.683832  0.129423  0.371272  1
  C  C56  1  0.018146  0.460493  0.336830  1
  C  C57  1  0.849530  0.797835  0.352662  1
  C  C58  1  0.176560  0.143881  0.355687  1
  C  C59  1  0.010692  0.475554  0.370343  1
  C  C60  1  0.342580  0.811643  0.336701  1
  C  C61  1  0.709407  0.078350  0.332826  1
  C  C62  1  0.545513  0.406001  0.351377  1
  C  C63  1  0.377315  0.742451  0.366326  1
  C  C64  1  0.738108  0.021046  0.363879  1
  C  C65  1  0.072373  0.352478  0.332063  1
  C  C66  1  0.903910  0.689418  0.346780  1
  C  C67  1  0.628067  0.240837  0.343700  1
  C  C68  1  0.461441  0.574216  0.358915  1
  C  C69  1  0.294972  0.907304  0.375883  1
  C  C70  1  0.730176  0.036852  0.330716  1
  C  C71  1  0.566188  0.364770  0.349273  1
  C  C72  1  0.398119  0.700929  0.364358  1
  C  C73  1  0.206000  0.085112  0.418157  1
  C  C74  1  0.538690  0.419623  0.385202  1
  C  C75  1  0.371575  0.753874  0.400792  1
  C  C76  1  0.622276  0.252484  0.411811  1
  C  C77  1  0.456442  0.584187  0.424886  1
  C  C78  1  0.788202  0.920785  0.392922  1
  C  C79  1  0.261157  0.974884  0.412330  1
  C  C80  1  0.594118  0.308895  0.380504  1
  C  C81  1  0.427503  0.642150  0.394081  1
  C  C82  1  0.657211  0.182681  0.408692  1
  C  C83  1  0.491398  0.514312  0.421898  1
  C  C84  1  0.822811  0.851369  0.388782  1
  C  C85  1  0.601936  0.293261  0.413452  1
  C  C86  1  0.435933  0.625295  0.426583  1
  C  C87  1  0.767801  0.961668  0.395403  1
  C  C88  1  0.149156  0.198705  0.394475  1
  C  C89  1  0.983675  0.529693  0.406236  1
  C  C90  1  0.816954  0.863102  0.423161  1
  C  C91  1  0.185453  0.126226  0.420987  1
  C  C92  1  0.518167  0.460685  0.386274  1
  C  C93  1  0.350992  0.795037  0.402458  1
  C  C94  1  0.677805  0.141441  0.405680  1
  C  C95  1  0.511878  0.473265  0.420268  1
  C  C96  1  0.843196  0.810541  0.387262  1
  C  C97  1  0.211610  0.073961  0.383716  1
  C  C98  1  0.046287  0.404511  0.400932  1
  C  C99  1  0.879599  0.737911  0.415712  1
  C  C100  1  0.240624  0.015974  0.414162  1
  C  C101  1  0.573752  0.349655  0.382600  1
  C  C102  1  0.406950  0.683283  0.396549  1
  C  C103  1  0.128894  0.239291  0.394232  1
  C  C104  1  0.963168  0.570788  0.407946  1
  C  C105  1  0.796567  0.904021  0.425472  1
  C  C106  1  0.232199  0.032800  0.381537  1
  C  C107  1  0.066853  0.363382  0.399403  1
  C  C108  1  0.900253  0.696607  0.413448  1
  C  C109  1  0.707757  0.081598  0.467975  1
  C  C110  1  0.039948  0.417148  0.434886  1
  C  C111  1  0.873546  0.749958  0.449783  1
  C  C112  1  0.123867  0.249321  0.461561  1
  C  C113  1  0.958120  0.580838  0.474581  1
  C  C114  1  0.289991  0.917117  0.442715  1
  C  C115  1  0.762960  0.971202  0.462029  1
  C  C116  1  0.095248  0.306575  0.430647  1
  C  C117  1  0.929308  0.638481  0.443635  1
  C  C118  1  0.158972  0.179179  0.458065  1
  C  C119  1  0.992940  0.511245  0.471702  1
  C  C120  1  0.324669  0.847740  0.438764  1
  C  C121  1  0.103399  0.290326  0.463311  1
  C  C122  1  0.937625  0.621898  0.476214  1
  C  C123  1  0.269556  0.958075  0.444917  1
  C  C124  1  0.650989  0.195067  0.443024  1
  C  C125  1  0.485263  0.526532  0.455926  1
  C  C126  1  0.318785  0.859457  0.473002  1
  C  C127  1  0.687252  0.122650  0.470637  1
  C  C128  1  0.019450  0.458196  0.436134  1
  C  C129  1  0.853015  0.791057  0.452073  1
  C  C130  1  0.179465  0.138145  0.455272  1
  C  C131  1  0.013416  0.470224  0.470231  1
  C  C132  1  0.345140  0.806726  0.436767  1
  C  C133  1  0.713636  0.069914  0.433743  1
  C  C134  1  0.547578  0.401960  0.450705  1
  C  C135  1  0.381517  0.734094  0.464993  1
  C  C136  1  0.742476  0.012229  0.464026  1
  C  C137  1  0.074795  0.347539  0.432261  1
  C  C138  1  0.908779  0.679593  0.445794  1
  C  C139  1  0.630517  0.236077  0.444357  1
  C  C140  1  0.464766  0.567601  0.457505  1
  C  C141  1  0.298318  0.900482  0.475279  1
  C  C142  1  0.734199  0.028761  0.431379  1
  C  C143  1  0.568081  0.360907  0.449329  1
  C  C144  1  0.402062  0.692966  0.462793  1
  C  C145  1  0.209525  0.078063  0.517764  1
  C  C146  1  0.541487  0.414093  0.484767  1
  C  C147  1  0.375340  0.746389  0.498995  1
  C  C148  1  0.625548  0.245967  0.511116  1
  C  C149  1  0.459765  0.577554  0.524338  1
  C  C150  1  0.791774  0.913512  0.492511  1
  C  C151  1  0.264732  0.967609  0.511753  1
  C  C152  1  0.596761  0.303542  0.480453  1
  C  C153  1  0.430995  0.635097  0.493314  1
  C  C154  1  0.660700  0.175739  0.507360  1
  C  C155  1  0.494553  0.508035  0.521588  1
  C  C156  1  0.826516  0.844065  0.488592  1
  C  C157  1  0.605046  0.287031  0.513041  1
  C  C158  1  0.439280  0.618585  0.525902  1
  C  C159  1  0.771309  0.954518  0.494602  1
  C  C160  1  0.152753  0.191559  0.492115  1
  C  C161  1  0.986898  0.523278  0.505777  1
  C  C162  1  0.820583  0.855862  0.522776  1
  C  C163  1  0.189033  0.119105  0.520160  1
  C  C164  1  0.521008  0.455113  0.486119  1
  C  C165  1  0.354843  0.787431  0.501585  1
  C  C166  1  0.681198  0.134697  0.504770  1
  C  C167  1  0.515033  0.467014  0.520237  1
  C  C168  1  0.847008  0.803023  0.486195  1
  C  C169  1  0.215458  0.066266  0.483580  1
  C  C170  1  0.049143  0.398850  0.500579  1
  C  C171  1  0.883288  0.730569  0.514241  1
  C  C172  1  0.244266  0.008616  0.513845  1
  C  C173  1  0.576276  0.344574  0.482017  1
  C  C174  1  0.410493  0.676161  0.495239  1
  C  C175  1  0.132241  0.232639  0.494050  1
  C  C176  1  0.966403  0.564334  0.507225  1
  C  C177  1  0.800078  0.896932  0.525104  1
  C  C178  1  0.235963  0.025196  0.481251  1
  C  C179  1  0.069638  0.357793  0.499130  1
  C  C180  1  0.903800  0.689488  0.512306  1
  C  C181  1  0.711372  0.074388  0.567591  1
  C  C182  1  0.043101  0.410883  0.534653  1
  C  C183  1  0.877068  0.742949  0.548290  1
  C  C184  1  0.127261  0.242535  0.560561  1
  C  C185  1  0.961245  0.574589  0.574094  1
  C  C186  1  0.293565  0.909898  0.542329  1
  C  C187  1  0.766485  0.964052  0.561439  1
  C  C188  1  0.098416  0.300230  0.530141  1
  C  C189  1  0.932641  0.631802  0.543045  1
  C  C190  1  0.162494  0.172169  0.556573  1
  C  C191  1  0.996092  0.504980  0.571469  1
  C  C192  1  0.328284  0.840530  0.538380  1
  C  C193  1  0.106732  0.283646  0.562720  1
  C  C194  1  0.940792  0.615552  0.575708  1
  C  C195  1  0.273081  0.950925  0.544326  1
  C  C196  1  0.654524  0.188033  0.541362  1
  C  C197  1  0.488463  0.520167  0.555650  1
  C  C198  1  0.322405  0.852214  0.572612  1
  C  C199  1  0.690901  0.115401  0.569588  1
  C  C200  1  0.022625  0.451903  0.536124  1
  C  C201  1  0.856576  0.783983  0.551084  1
  C  C202  1  0.183026  0.131071  0.554282  1
  C  C203  1  0.016591  0.463932  0.570221  1
  C  C204  1  0.348789  0.799478  0.535719  1
  C  C205  1  0.717255  0.062671  0.533354  1
  C  C206  1  0.550778  0.395595  0.550430  1
  C  C207  1  0.385051  0.727061  0.563331  1
  C  C208  1  0.746049  0.005011  0.563641  1
  C  C209  1  0.077921  0.341290  0.531774  1
  C  C210  1  0.912174  0.672807  0.544794  1
  C  C211  1  0.633979  0.229162  0.543562  1
  C  C212  1  0.467960  0.561221  0.557026  1
  C  C213  1  0.301842  0.893367  0.574976  1
  C  C214  1  0.737723  0.021645  0.531076  1
  C  C215  1  0.571274  0.354526  0.548850  1
  C  C216  1  0.405524  0.686051  0.561999  1
  C  C217  1  0.213229  0.070759  0.617573  1
  C  C218  1  0.544642  0.407816  0.584458  1
  C  C219  1  0.378829  0.739447  0.597663  1
  C  C220  1  0.629091  0.238845  0.609807  1
  C  C221  1  0.462288  0.572473  0.623756  1
  C  C222  1  0.795417  0.906153  0.592193  1
  C  C223  1  0.268239  0.960460  0.610952  1
  C  C224  1  0.600108  0.296832  0.579772  1
  C  C225  1  0.434104  0.628867  0.592903  1
  C  C226  1  0.664466  0.168253  0.605563  1
  C  C227  1  0.497350  0.502505  0.621153  1
  C  C228  1  0.830041  0.837015  0.588198  1
  C  C229  1  0.608538  0.279977  0.612274  1
  C  C230  1  0.441923  0.613233  0.625851  1
  C  C231  1  0.774884  0.947244  0.594025  1
  C  C232  1  0.156442  0.184217  0.590643  1
  C  C233  1  0.989754  0.517617  0.605424  1
  C  C234  1  0.824430  0.848167  0.622639  1
  C  C235  1  0.192845  0.111586  0.619093  1
  C  C236  1  0.524162  0.448863  0.586087  1
  C  C237  1  0.358236  0.780687  0.600676  1
  C  C238  1  0.685049  0.127091  0.603897  1
  C  C239  1  0.517874  0.461443  0.620082  1
  C  C240  1  0.850587  0.795902  0.585368  1
  C  C241  1  0.219087  0.059026  0.583194  1
  C  C242  1  0.052366  0.392435  0.600119  1
  C  C243  1  0.886884  0.723423  0.611880  1
  C  C244  1  0.247839  0.001343  0.613434  1
  C  C245  1  0.579599  0.337941  0.581470  1
  C  C246  1  0.413765  0.669644  0.594545  1
  C  C247  1  0.135788  0.225521  0.592907  1
  C  C248  1  0.969188  0.558745  0.606952  1
  C  C249  1  0.803842  0.889328  0.624819  1
  C  C250  1  0.239474  0.018107  0.580883  1
  C  C251  1  0.072873  0.351339  0.598409  1
  C  C252  1  0.907147  0.682836  0.612123  1
  C  C253  1  0.713786  0.069982  0.667123  1
  C  C254  1  0.045680  0.405745  0.633878  1
  C  C255  1  0.880097  0.736949  0.647412  1
  C  C256  1  0.132130  0.232710  0.659576  1
  C  C257  1  0.963667  0.569650  0.674292  1
  C  C258  1  0.297933  0.901082  0.642476  1
  C  C259  1  0.771235  0.954336  0.660405  1
  C  C260  1  0.101997  0.292990  0.629367  1
  C  C261  1  0.935100  0.626809  0.643024  1
  C  C262  1  0.166072  0.165073  0.655372  1
  C  C263  1  0.997276  0.502714  0.671465  1
  C  C264  1  0.331690  0.833725  0.638638  1
  C  C265  1  0.111393  0.274041  0.661232  1
  C  C266  1  0.943100  0.610613  0.676381  1
  C  C267  1  0.277344  0.942198  0.643184  1
  C  C268  1  0.658726  0.179677  0.640030  1
  C  C269  1  0.490527  0.516127  0.654978  1
  C  C270  1  0.326633  0.843778  0.673529  1
  C  C271  1  0.693461  0.110484  0.669654  1
  C  C272  1  0.025348  0.446574  0.636013  1
  C  C273  1  0.859480  0.778246  0.650668  1
  C  C274  1  0.186511  0.124293  0.653693  1
  C  C275  1  0.017895  0.461635  0.669525  1
  C  C276  1  0.352209  0.792705  0.635084  1
  C  C277  1  0.720982  0.055329  0.633121  1
  C  C278  1  0.553648  0.389873  0.649289  1
  C  C279  1  0.388252  0.720740  0.659473  1
  C  C280  1  0.750594  -0.004504  0.662311  1
  C  C281  1  0.081606  0.333951  0.630744  1
  C  C282  1  0.915198  0.666820  0.644778  1
  C  C283  1  0.637922  0.221199  0.641998  1
  C  C284  1  0.469852  0.557358  0.657083  1
  C  C285  1  0.305865  0.885276  0.675639  1
  C  C286  1  0.741068  0.014824  0.630472  1
  C  C287  1  0.574600  0.347912  0.647440  1
  C  C288  1  0.407974  0.681291  0.662655  1
  C  C289  1  0.214436  0.068808  0.717642  1
  C  C290  1  0.550392  0.396226  0.683699  1
  C  C291  1  0.375239  0.746791  0.726387  1
  C  C292  1  0.632967  0.230993  0.709293  1
  C  C293  1  0.463832  0.569288  0.724211  1
  C  C294  1  0.799322  0.898284  0.692212  1
  C  C295  1  0.271824  0.953072  0.710122  1
  C  C296  1  0.608320  0.280133  0.680606  1
  C  C297  1  0.438944  0.618857  0.695115  1
  C  C298  1  0.668027  0.161196  0.704713  1
  C  C299  1  0.499198  0.498933  0.721286  1
  C  C300  1  0.834295  0.828543  0.688398  1
  C  C301  1  0.614181  0.268391  0.711593  1
  C  C302  1  0.445067  0.606624  0.725999  1
  C  C303  1  0.778899  0.939018  0.693953  1
  C  C304  1  0.160568  0.176016  0.691173  1
  C  C305  1  0.991467  0.514292  0.706240  1
  C  C306  1  0.833548  0.829964  0.724294  1
  C  C307  1  0.195783  0.105935  0.720659  1
  C  C308  1  0.522060  0.453374  0.688313  1
  C  C309  1  0.362202  0.772891  0.701104  1
  C  C310  1  0.687777  0.121839  0.705681  1
  C  C311  1  0.517984  0.461551  0.720174  1
  C  C312  1  0.855342  0.786523  0.686208  1
  C  C313  1  0.218345  0.060944  0.685707  1
  C  C314  1  0.055615  0.385850  0.699169  1
  C  C315  1  0.885638  0.726130  0.729846  1
  C  C316  1  0.253138  0.990293  0.712443  1
  C  C317  1  0.579875  0.337550  0.681130  1
  C  C318  1  0.407869  0.681773  0.697850  1
  C  C319  1  0.139617  0.217781  0.692995  1
  C  C320  1  0.970922  0.555202  0.708227  1
  C  C321  1  0.802232  0.892571  0.728591  1
  C  C322  1  0.247161  0.002298  0.681463  1
  C  C323  1  0.075581  0.346082  0.697423  1
  C  C324  1  0.903187  0.691077  0.713769  1
