# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   21.13012402
_cell_length_b   18.28295760
_cell_length_c   26.06642793
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C1023
_cell_volume   10070.0127138
_cell_formula_units_Z   1023
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  0.049638  0.214472  0.840525  1
  C  C2  1  0.050814  0.212877  0.087958  1
  C  C3  1  0.049994  0.214699  0.342209  1
  C  C4  1  0.049764  0.214574  0.591927  1
  C  C5  1  0.060948  0.466037  0.834010  1
  C  C6  1  0.061294  0.465908  0.084579  1
  C  C7  1  0.060394  0.465834  0.334433  1
  C  C8  1  0.060420  0.465628  0.583885  1
  C  C9  1  0.049495  0.715470  -0.127108  1
  C  C10  1  0.051645  0.717977  0.119268  1
  C  C11  1  0.050412  0.717356  0.366309  1
  C  C12  1  0.049197  0.716350  0.619139  1
  C  C13  1  0.045552  0.963264  0.845102  1
  C  C14  1  0.041989  0.971697  0.095601  1
  C  C15  1  0.045662  0.966274  0.347612  1
  C  C16  1  0.045251  0.964302  0.596261  1
  C  C17  1  0.303428  0.209751  0.866106  1
  C  C18  1  0.303347  0.211009  0.116766  1
  C  C19  1  0.302646  0.210576  0.363876  1
  C  C20  1  0.301782  0.210525  0.614330  1
  C  C21  1  0.304541  0.465547  -0.119161  1
  C  C22  1  0.304741  0.467182  0.129741  1
  C  C23  1  0.303553  0.466209  0.379283  1
  C  C24  1  0.303419  0.465738  0.630470  1
  C  C25  1  0.296131  0.715550  0.858829  1
  C  C26  1  0.297480  0.717760  0.108921  1
  C  C27  1  0.295477  0.716119  0.358252  1
  C  C28  1  0.294115  0.715485  0.608416  1
  C  C29  1  0.297250  0.966142  0.840347  1
  C  C30  1  0.297089  0.968596  0.090104  1
  C  C31  1  0.296866  0.966429  0.338701  1
  C  C32  1  0.296784  0.966067  0.589929  1
  C  C33  1  0.553293  0.214442  -0.109458  1
  C  C34  1  0.553579  0.214754  0.143266  1
  C  C35  1  0.552066  0.214034  0.392536  1
  C  C36  1  0.551716  0.214595  0.640758  1
  C  C37  1  0.550049  0.459137  -0.094412  1
  C  C38  1  0.550493  0.460136  0.155488  1
  C  C39  1  0.549114  0.459688  0.405960  1
  C  C40  1  0.548957  0.459776  0.655840  1
  C  C41  1  0.547352  0.710586  0.859067  1
  C  C42  1  0.548617  0.712073  0.109371  1
  C  C43  1  0.547131  0.711114  0.359941  1
  C  C44  1  0.546216  0.710978  0.609484  1
  C  C45  1  0.540654  0.965174  -0.098539  1
  C  C46  1  0.542090  0.966631  0.150365  1
  C  C47  1  0.540022  0.965898  0.400824  1
  C  C48  1  0.539318  0.965440  0.651216  1
  C  C49  1  0.801253  0.217442  0.845519  1
  C  C50  1  0.804013  0.216219  0.096588  1
  C  C51  1  0.801860  0.216966  0.346725  1
  C  C52  1  0.801372  0.217823  0.596129  1
  C  C53  1  0.797232  0.466151  0.845737  1
  C  C54  1  0.798176  0.464465  0.096295  1
  C  C55  1  0.796539  0.465808  0.345990  1
  C  C56  1  0.797017  0.466798  0.595768  1
  C  C57  1  0.804384  0.717186  0.860561  1
  C  C58  1  0.805125  0.716966  0.107702  1
  C  C59  1  0.804214  0.717272  0.358419  1
  C  C60  1  0.804073  0.717848  0.610407  1
  C  C61  1  0.792770  0.969874  0.852998  1
  C  C62  1  0.796983  0.969806  0.106080  1
  C  C63  1  0.794096  0.968915  0.355898  1
  C  C64  1  0.792734  0.969565  0.604203  1
  C  C65  1  0.049914  0.127430  0.083639  1
  C  C66  1  0.044914  0.125299  0.341070  1
  C  C67  1  0.045028  0.125184  0.590372  1
  C  C68  1  0.045280  0.125048  0.838771  1
  C  C69  1  0.052546  0.377000  0.081703  1
  C  C70  1  0.052473  0.376751  0.332634  1
  C  C71  1  0.052566  0.376539  0.582505  1
  C  C72  1  0.052296  0.377071  0.831861  1
  C  C73  1  0.051807  0.628421  0.113720  1
  C  C74  1  0.051627  0.628311  0.359709  1
  C  C75  1  0.050007  0.627472  0.611680  1
  C  C76  1  0.050251  0.626636  0.864954  1
  C  C77  1  0.052971  0.880321  0.100073  1
  C  C78  1  0.052809  0.877335  0.351783  1
  C  C79  1  0.050580  0.876101  0.606020  1
  C  C80  1  0.050872  0.875048  0.854899  1
  C  C81  1  0.299613  0.128749  0.091823  1
  C  C82  1  0.299624  0.127531  0.340183  1
  C  C83  1  0.298710  0.127742  0.590225  1
  C  C84  1  0.300141  0.127582  0.840990  1
  C  C85  1  0.301844  0.377588  0.126457  1
  C  C86  1  0.300894  0.376795  0.375198  1
  C  C87  1  0.300981  0.376293  0.626509  1
  C  C88  1  0.302305  0.376007  -0.122100  1
  C  C89  1  0.296009  0.628969  0.118205  1
  C  C90  1  0.294415  0.627574  0.367826  1
  C  C91  1  0.293114  0.627124  0.618727  1
  C  C92  1  0.294529  0.627169  0.869075  1
  C  C93  1  0.296139  0.879751  0.099625  1
  C  C94  1  0.295234  0.877916  0.348838  1
  C  C95  1  0.294450  0.877335  0.598909  1
  C  C96  1  0.295497  0.877370  0.849247  1
  C  C97  1  0.555847  0.128369  0.126181  1
  C  C98  1  0.554610  0.127299  0.376526  1
  C  C99  1  0.553885  0.127219  0.626601  1
  C  C100  1  0.555464  0.127090  -0.123728  1
  C  C101  1  0.545356  0.377887  0.180648  1
  C  C102  1  0.543870  0.377331  0.430768  1
  C  C103  1  0.543659  0.377300  0.680429  1
  C  C104  1  0.544459  0.377066  -0.069174  1
  C  C105  1  0.556552  0.626353  0.126892  1
  C  C106  1  0.555291  0.625539  0.377737  1
  C  C107  1  0.554588  0.625495  0.627436  1
  C  C108  1  0.555860  0.625173  -0.122823  1
  C  C109  1  0.546800  0.878866  0.137936  1
  C  C110  1  0.544799  0.878332  0.387602  1
  C  C111  1  0.543556  0.877621  0.638805  1
  C  C112  1  0.544944  0.877346  -0.110971  1
  C  C113  1  0.803201  0.127354  0.098918  1
  C  C114  1  0.800267  0.127482  0.348682  1
  C  C115  1  0.798949  0.128374  0.597718  1
  C  C116  1  0.798799  0.128036  0.847946  1
  C  C117  1  0.800465  0.375009  0.096272  1
  C  C118  1  0.798451  0.376284  0.345972  1
  C  C119  1  0.798406  0.377277  0.596108  1
  C  C120  1  0.798481  0.376622  0.846062  1
  C  C121  1  0.812275  0.627993  0.113407  1
  C  C122  1  0.811092  0.628399  0.364276  1
  C  C123  1  0.811493  0.628914  0.615236  1
  C  C124  1  0.812070  0.628265  0.865423  1
  C  C125  1  0.792218  0.882162  0.092260  1
  C  C126  1  0.790544  0.880888  0.344619  1
  C  C127  1  0.790000  0.881340  0.593541  1
  C  C128  1  0.789723  0.881776  0.841847  1
  C  C129  1  -0.019630  1.000968  0.867254  1
  C  C130  1  -0.018807  1.003658  0.121716  1
  C  C131  1  -0.019207  1.001088  0.372526  1
  C  C132  1  -0.019775  1.001045  0.619548  1
  C  C133  1  -0.009298  0.255845  0.869823  1
  C  C134  1  -0.005803  0.254007  0.121477  1
  C  C135  1  -0.008325  0.255805  0.372489  1
  C  C136  1  -0.009088  0.256003  0.621325  1
  C  C137  1  -0.007421  0.505871  0.845071  1
  C  C138  1  -0.006817  0.505282  0.097246  1
  C  C139  1  -0.007888  0.506208  0.344803  1
  C  C140  1  -0.007951  0.506475  0.592889  1
  C  C141  1  -0.011500  0.754869  0.845042  1
  C  C142  1  -0.010370  0.755483  0.092220  1
  C  C143  1  -0.009638  0.755879  0.336563  1
  C  C144  1  -0.010484  0.756441  0.589899  1
  C  C145  1  0.239436  1.002514  -0.126209  1
  C  C146  1  0.238297  1.005131  0.121992  1
  C  C147  1  0.239384  1.003413  0.372201  1
  C  C148  1  0.239242  1.002872  0.623437  1
  C  C149  1  0.246062  0.246668  -0.100032  1
  C  C150  1  0.245452  0.248208  0.149612  1
  C  C151  1  0.245511  0.247936  0.397740  1
  C  C152  1  0.245252  0.247429  0.649088  1
  C  C153  1  0.245193  0.501453  -0.087185  1
  C  C154  1  0.245841  0.503484  0.162004  1
  C  C155  1  0.245104  0.502235  0.412298  1
  C  C156  1  0.244497  0.501636  0.662970  1
  C  C157  1  0.238528  0.753082  -0.108104  1
  C  C158  1  0.239081  0.755618  0.140731  1
  C  C159  1  0.236854  0.753434  0.390256  1
  C  C160  1  0.236136  0.752751  0.641198  1
  C  C161  1  0.484154  1.004497  0.867976  1
  C  C162  1  0.485363  1.006334  0.116976  1
  C  C163  1  0.483907  1.005180  0.366889  1
  C  C164  1  0.483125  1.004579  0.617273  1
  C  C165  1  0.482453  0.250273  -0.115134  1
  C  C166  1  0.482807  0.250462  0.136291  1
  C  C167  1  0.481374  0.249919  0.385880  1
  C  C168  1  0.480677  0.250091  0.635674  1
  C  C169  1  0.483934  0.505867  -0.089261  1
  C  C170  1  0.484389  0.507089  0.161010  1
  C  C171  1  0.482916  0.506285  0.411112  1
  C  C172  1  0.482642  0.506175  0.660899  1
  C  C173  1  0.483761  0.748981  -0.116277  1
  C  C174  1  0.485230  0.750734  0.134471  1
  C  C175  1  0.483562  0.749709  0.384491  1
  C  C176  1  0.482305  0.749365  0.633616  1
  C  C177  1  0.724052  1.003895  -0.129589  1
  C  C178  1  0.726794  1.003639  0.120260  1
  C  C179  1  0.724460  1.003354  0.370320  1
  C  C180  1  0.723390  1.004083  0.619385  1
  C  C181  1  0.736626  0.254323  0.869619  1
  C  C182  1  0.738846  0.253586  0.120310  1
  C  C183  1  0.737118  0.254047  0.370471  1
  C  C184  1  0.736408  0.254868  0.619453  1
  C  C185  1  0.746107  0.505290  -0.115181  1
  C  C186  1  0.746460  0.504902  0.134165  1
  C  C187  1  0.745313  0.505305  0.384811  1
  C  C188  1  0.745407  0.505790  0.634471  1
  C  C189  1  0.733858  0.748022  -0.123839  1
  C  C190  1  0.735701  0.748314  0.125745  1
  C  C191  1  0.734313  0.747506  0.376367  1
  C  C192  1  0.733363  0.748015  0.626133  1
  C  C193  1  -0.016200  0.090658  0.371817  1
  C  C194  1  -0.016684  0.090578  0.620312  1
  C  C195  1  -0.016426  0.090482  0.868737  1
  C  C196  1  -0.006729  0.342504  0.115063  1
  C  C197  1  -0.007819  0.344939  0.365815  1
  C  C198  1  -0.008027  0.345232  0.615543  1
  C  C199  1  -0.008182  0.345163  0.864773  1
  C  C200  1  -0.006065  0.591730  0.080127  1
  C  C201  1  -0.006441  0.591929  0.326218  1
  C  C202  1  -0.005442  0.592365  0.574768  1
  C  C203  1  -0.005285  0.592136  0.827835  1
  C  C204  1  -0.012959  0.839568  0.115733  1
  C  C205  1  -0.014637  0.836083  0.364534  1
  C  C206  1  -0.015671  0.834037  0.621346  1
  C  C207  1  -0.014978  0.834833  -0.126444  1
  C  C208  1  0.233192  0.093922  0.114121  1
  C  C209  1  0.234717  0.092136  0.364166  1
  C  C210  1  0.234992  0.091695  0.615863  1
  C  C211  1  0.235622  0.091133  0.864964  1
  C  C212  1  0.241896  0.337363  0.155167  1
  C  C213  1  0.241842  0.336797  0.405238  1
  C  C214  1  0.241637  0.336345  0.656238  1
  C  C215  1  0.241987  0.335721  -0.093960  1
  C  C216  1  0.240839  0.592476  0.154360  1
  C  C217  1  0.239813  0.591086  0.404662  1
  C  C218  1  0.238742  0.590505  0.655757  1
  C  C219  1  0.239720  0.590349  -0.094423  1
  C  C220  1  0.238473  0.845063  0.134169  1
  C  C221  1  0.237651  0.842470  0.383060  1
  C  C222  1  0.237440  0.841701  0.633718  1
  C  C223  1  0.238657  0.842061  -0.115617  1
  C  C224  1  0.494731  0.091076  0.097553  1
  C  C225  1  0.494294  0.089403  0.346856  1
  C  C226  1  0.492855  0.089218  0.597970  1
  C  C227  1  0.493949  0.089002  0.848375  1
  C  C228  1  0.483616  0.335455  0.156865  1
  C  C229  1  0.482171  0.334749  0.406570  1
  C  C230  1  0.481722  0.334803  0.656569  1
  C  C231  1  0.482616  0.334385  -0.093034  1
  C  C232  1  0.489997  0.595419  0.151140  1
  C  C233  1  0.488409  0.594673  0.401651  1
  C  C234  1  0.487733  0.594568  0.651320  1
  C  C235  1  0.489038  0.594266  -0.098851  1
  C  C236  1  0.477622  0.839646  0.129453  1
  C  C237  1  0.475816  0.838539  0.379268  1
  C  C238  1  0.474686  0.838263  0.628992  1
  C  C239  1  0.475958  0.837941  -0.120141  1
  C  C240  1  0.738645  0.092383  0.122925  1
  C  C241  1  0.734909  0.092145  0.372548  1
  C  C242  1  0.733982  0.092812  0.622163  1
  C  C243  1  0.735098  0.092468  -0.125500  1
  C  C244  1  0.736822  0.342767  0.124865  1
  C  C245  1  0.735391  0.343383  0.375098  1
  C  C246  1  0.735105  0.344117  0.624789  1
  C  C247  1  0.735391  0.343577  -0.124922  1
  C  C248  1  0.741641  0.592812  0.123042  1
  C  C249  1  0.740366  0.593000  0.372994  1
  C  C250  1  0.740528  0.593475  0.622631  1
  C  C251  1  0.741087  0.592953  -0.127138  1
  C  C252  1  0.739361  0.837868  0.126581  1
  C  C253  1  0.737632  0.836907  0.379342  1
  C  C254  1  0.736100  0.837536  0.627345  1
  C  C255  1  0.737263  0.837537  -0.123158  1
  C  C256  1  -0.010460  0.214148  -0.006256  1
  C  C257  1  -0.011117  0.214263  0.248413  1
  C  C258  1  -0.011394  0.214932  0.497328  1
  C  C259  1  -0.011768  0.215444  0.745869  1
  C  C260  1  -0.005254  0.465584  -0.019900  1
  C  C261  1  -0.006244  0.466163  0.230151  1
  C  C262  1  -0.006760  0.467731  0.478406  1
  C  C263  1  -0.006072  0.467883  0.728932  1
  C  C264  1  -0.006854  0.712164  -0.034188  1
  C  C265  1  -0.007938  0.712436  0.210722  1
  C  C266  1  -0.008320  0.713349  0.458868  1
  C  C267  1  -0.007424  0.713647  0.713170  1
  C  C268  1  -0.013596  0.961751  -0.009636  1
  C  C269  1  -0.013227  0.960273  0.248797  1
  C  C270  1  -0.013762  0.960753  0.496288  1
  C  C271  1  -0.014765  0.961749  0.743221  1
  C  C272  1  0.242614  0.211587  0.016974  1
  C  C273  1  0.240119  0.211756  0.266629  1
  C  C274  1  0.240859  0.211747  0.515403  1
  C  C275  1  0.241472  0.211768  0.766936  1
  C  C276  1  0.242793  0.460610  0.035335  1
  C  C277  1  0.241623  0.461270  0.284793  1
  C  C278  1  0.241331  0.460962  0.535484  1
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