# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   23.33568589
_cell_length_b   19.51282978
_cell_length_c   20.17651558
_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   C559
_cell_volume   9187.28086549
_cell_formula_units_Z   559
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  0.387245  0.592896  0.430474  1
  C  C2  1  0.887116  0.593846  0.432213  1
  C  C3  1  0.035322  0.561105  0.815631  1
  C  C4  1  0.535588  0.561749  0.817325  1
  C  C5  1  0.376941  0.726844  0.678702  1
  C  C6  1  0.876941  0.726844  0.678702  1
  C  C7  1  0.099370  0.239810  0.247852  1
  C  C8  1  0.599370  0.239810  0.247852  1
  C  C9  1  0.113233  0.593846  0.432213  1
  C  C10  1  0.613104  0.592896  0.430474  1
  C  C11  1  0.465019  0.810633  0.108496  1
  C  C12  1  0.964888  0.813282  0.112074  1
  C  C13  1  0.330676  0.615241  0.317143  1
  C  C14  1  0.830663  0.617153  0.319109  1
  C  C15  1  0.500175  0.561685  0.011670  1
  C  C16  1  0.351437  0.650556  0.108436  1
  C  C17  1  0.850023  0.654984  0.111156  1
  C  C18  1  0.035331  0.188506  0.605954  1
  C  C19  1  0.535330  0.189943  0.608496  1
  C  C20  1  0.037029  0.696809  0.023839  1
  C  C21  1  0.535617  0.694156  0.023392  1
  C  C22  1  0.035565  0.560661  0.677738  1
  C  C23  1  0.535588  0.561749  0.678379  1
  C  C24  1  0.113676  0.404773  0.928922  1
  C  C25  1  0.613104  0.407680  0.930474  1
  C  C26  1  0.070549  0.628274  0.014574  1
  C  C27  1  0.556255  0.613888  0.022930  1
  C  C28  1  0.149455  0.347004  0.885173  1
  C  C29  1  0.648912  0.350020  0.887268  1
  C  C30  1  0.372675  0.730633  0.108482  1
  C  C31  1  0.872700  0.734104  0.111669  1
  C  C32  1  0.428802  0.552392  0.747852  1
  C  C33  1  0.928395  0.550927  0.746988  1
  C  C34  1  0.071771  0.449214  0.249596  1
  C  C35  1  0.571547  0.448183  0.247852  1
  C  C36  1  0.464732  0.694156  0.023392  1
  C  C37  1  0.963320  0.696809  0.023839  1
  C  C38  1  0.149094  0.348522  0.606714  1
  C  C39  1  0.648912  0.350020  0.608436  1
  C  C40  1  0.056275  0.614579  0.474443  1
  C  C41  1  0.556255  0.613888  0.472773  1
  C  C42  1  0.035554  0.439082  0.318959  1
  C  C43  1  0.535588  0.438826  0.317325  1
  C  C44  1  0.422597  0.841197  0.747852  1
  C  C45  1  0.922597  0.841197  0.747852  1
  C  C46  1  0.148156  0.463745  0.677423  1
  C  C47  1  0.647923  0.465542  0.678453  1
  C  C48  1  0.464761  0.561749  0.817325  1
  C  C49  1  0.965027  0.561105  0.815631  1
  C  C50  1  1.000175  0.469315  0.060747  1
  C  C51  1  0.500175  0.485434  0.057382  1
  C  C52  1  0.320677  0.252821  0.430412  1
  C  C53  1  0.820677  0.252821  0.430412  1
  C  C54  1  0.110367  0.525496  0.109955  1
  C  C55  1  0.612980  0.521007  0.108716  1
  C  C56  1  0.071954  0.550927  0.746988  1
  C  C57  1  0.571547  0.552392  0.747852  1
  C  C58  1  0.123408  0.273732  0.317002  1
  C  C59  1  0.623408  0.273732  0.317002  1
  C  C60  1  0.429673  0.247755  0.930412  1
  C  C61  1  0.929612  0.245064  0.927861  1
  C  C62  1  0.123408  0.273732  0.178702  1
  C  C63  1  0.623408  0.273732  0.178702  1
  C  C64  1  0.035851  0.304061  0.969809  1
  C  C65  1  0.535617  0.306419  0.972312  1
  C  C66  1  0.444094  0.386688  0.522930  1
  C  C67  1  0.944086  0.385713  0.521887  1
  C  C68  1  0.113133  0.522307  0.388212  1
  C  C69  1  0.612980  0.521007  0.386987  1
  C  C70  1  0.320677  0.252821  0.065292  1
  C  C71  1  0.820677  0.252821  0.065292  1
  C  C72  1  0.129220  0.501407  0.746776  1
  C  C73  1  0.629052  0.503343  0.747852  1
  C  C74  1  0.035352  0.187479  0.884587  1
  C  C75  1  0.535330  0.189943  0.887207  1
  C  C76  1  0.035261  0.439738  0.180839  1
  C  C77  1  0.535588  0.438826  0.178379  1
  C  C78  1  0.444318  0.527970  0.607933  1
  C  C79  1  0.944010  0.526678  0.607558  1
  C  C80  1  0.464732  0.694156  0.472312  1
  C  C81  1  0.964726  0.694828  0.474927  1
  C  C82  1  0.000175  0.514126  0.557381  1
  C  C83  1  0.500175  0.515141  0.557382  1
  C  C84  1  0.351437  0.350020  0.887268  1
  C  C85  1  0.850895  0.347004  0.885173  1
  C  C86  1  0.464840  0.840207  0.247852  1
  C  C87  1  0.964841  0.842683  0.251707  1
  C  C88  1  0.372675  0.730633  0.387221  1
  C  C89  1  0.872608  0.732006  0.390246  1
  C  C90  1  0.148663  0.463132  0.815831  1
  C  C91  1  0.647923  0.465542  0.817251  1
  C  C92  1  0.444094  0.386688  0.972773  1
  C  C93  1  0.943103  0.383235  0.970891  1
  C  C94  1  0.056649  0.524862  0.885717  1
  C  C95  1  0.556031  0.527970  0.887771  1
  C  C96  1  0.169911  0.383496  0.676953  1
  C  C97  1  0.669673  0.385334  0.678561  1
  C  C98  1  0.444318  0.472606  0.107933  1
  C  C99  1  0.943859  0.471865  0.108606  1
  C  C100  1  0.035623  0.694828  0.474927  1
  C  C101  1  0.535617  0.694156  0.472312  1
  C  C102  1  0.285509  0.340207  0.247852  1
  C  C103  1  0.785509  0.340207  0.247852  1
  C  C104  1  1.000175  0.436907  0.983098  1
  C  C105  1  0.500175  0.438891  0.984034  1
  C  C106  1  0.444318  0.472606  0.387771  1
  C  C107  1  0.943985  0.473593  0.388872  1
  C  C108  1  0.351437  0.650556  0.387268  1
  C  C109  1  0.851342  0.651940  0.389521  1
  C  C110  1  0.430514  0.177350  0.817020  1
  C  C111  1  0.930482  0.174956  0.814361  1
  C  C112  1  0.000175  0.562213  0.484946  1
  C  C113  1  0.500175  0.561685  0.484034  1
  C  C114  1  0.000175  0.438109  0.511434  1
  C  C115  1  0.500175  0.438891  0.511670  1
  C  C116  1  0.330676  0.615241  0.178561  1
  C  C117  1  0.831266  0.618428  0.180569  1
  C  C118  1  0.464840  0.160369  0.747852  1
  C  C119  1  0.964840  0.158278  0.745148  1
  C  C120  1  0.464732  0.306419  0.523392  1
  C  C121  1  0.964729  0.305456  0.521568  1
  C  C122  1  0.465019  0.810633  0.387207  1
  C  C123  1  0.965018  0.812014  0.390846  1
  C  C124  1  0.115137  0.597185  0.064536  1
  C  C125  1  0.613104  0.592896  0.065229  1
  C  C126  1  0.330676  0.385334  0.678561  1
  C  C127  1  0.830438  0.383496  0.676953  1
  C  C128  1  0.373408  0.226844  0.817002  1
  C  C129  1  0.873273  0.224233  0.814507  1
  C  C130  1  0.430514  0.177350  0.678684  1
  C  C131  1  0.930490  0.175534  0.676059  1
  C  C132  1  0.387245  0.592896  0.065229  1
  C  C133  1  0.885212  0.597185  0.064536  1
  C  C134  1  0.387245  0.407680  0.930474  1
  C  C135  1  0.886673  0.404773  0.928922  1
  C  C136  1  0.285330  0.310633  0.108496  1
  C  C137  1  0.785330  0.310633  0.108496  1
  C  C138  1  0.056364  0.473593  0.388872  1
  C  C139  1  0.556031  0.472606  0.387771  1
  C  C140  1  0.057246  0.383235  0.970891  1
  C  C141  1  0.556255  0.386688  0.972773  1
  C  C142  1  0.464761  0.438826  0.178379  1
  C  C143  1  0.965088  0.439738  0.180839  1
  C  C144  1  0.070727  0.246523  0.563061  1
  C  C145  1  0.570677  0.247755  0.565292  1
  C  C146  1  0.422597  0.159378  0.247852  1
  C  C147  1  0.922597  0.159378  0.247852  1
  C  C148  1  0.327752  0.659378  0.247852  1
  C  C149  1  0.827837  0.661975  0.250332  1
  C  C150  1  0.430514  0.823226  0.317020  1
  C  C151  1  0.930501  0.825206  0.320764  1
  C  C152  1  0.419673  0.115241  0.178561  1
  C  C153  1  0.919673  0.115241  0.178561  1
  C  C154  1  0.127759  0.268476  0.606302  1
  C  C155  1  0.627674  0.269943  0.608482  1
  C  C156  1  0.319835  0.323226  0.178684  1
  C  C157  1  0.819835  0.323226  0.178684  1
  C  C158  1  0.377674  0.230633  0.108482  1
  C  C159  1  0.877674  0.230633  0.108482  1
  C  C160  1  0.376941  0.273732  0.317002  1
  C  C161  1  0.876941  0.273732  0.317002  1
  C  C162  1  0.387369  0.521007  0.386987  1
  C  C163  1  0.887216  0.522307  0.388212  1
  C  C164  1  0.035509  0.158278  0.745148  1
  C  C165  1  0.535509  0.160369  0.747852  1
  C  C166  1  0.387369  0.479569  0.886987  1
  C  C167  1  0.885860  0.476737  0.885682  1
  C  C168  1  0.372675  0.269943  0.887221  1
  C  C169  1  0.872468  0.267136  0.884908  1
  C  C170  1  0.349370  0.260765  0.747852  1
  C  C171  1  0.849168  0.258441  0.745547  1
  C  C172  1  0.056264  0.385713  0.521887  1
  C  C173  1  0.556255  0.386688  0.522930  1
  C  C174  1  0.070737  0.245064  0.927861  1
  C  C175  1  0.570677  0.247755  0.930412  1
  C  C176  1  0.464761  0.561749  0.678379  1
  C  C177  1  0.964784  0.560661  0.677738  1
  C  C178  1  0.429673  0.752821  0.430412  1
  C  C179  1  0.929629  0.753867  0.433571  1
  C  C180  1  0.352426  0.535034  0.178453  1
  C  C181  1  0.855303  0.538573  0.179104  1
  C  C182  1  0.387245  0.407680  0.565229  1
  C  C183  1  0.887048  0.406538  0.563916  1
  C  C184  1  0.128344  0.499841  0.248936  1
  C  C185  1  0.629052  0.497232  0.247852  1
  C  C186  1  0.398912  0.150556  0.108436  1
  C  C187  1  0.898912  0.150556  0.108436  1
  C  C188  1  0.400979  0.239810  0.247852  1
  C  C189  1  0.900979  0.239810  0.247852  1
  C  C190  1  0.330676  0.385334  0.817143  1
  C  C191  1  0.830133  0.382611  0.815410  1
  C  C192  1  1.000175  0.502435  0.927913  1
  C  C193  1  0.500175  0.515141  0.938322  1
  C  C194  1  0.444094  0.613888  0.022930  1
  C  C195  1  0.929800  0.628274  0.014574  1
  C  C196  1  0.429673  0.752821  0.065292  1
  C  C197  1  0.930011  0.755783  0.069024  1
  C  C198  1  0.069859  0.175534  0.676059  1
  C  C199  1  0.569835  0.177350  0.678684  1
  C  C200  1  0.464732  0.306419  0.972312  1
  C  C201  1  0.964498  0.304061  0.969809  1
  C  C202  1  0.000175  0.486200  0.439017  1
  C  C203  1  0.500175  0.485434  0.438322  1
  C  C204  1  0.113254  0.478202  0.607722  1
  C  C205  1  0.612980  0.479569  0.608716  1
  C  C206  1  0.035620  0.305456  0.521568  1
  C  C207  1  0.535617  0.306419  0.523392  1
  C  C208  1  0.444318  0.527970  0.887771  1
  C  C209  1  0.943700  0.524862  0.885717  1
  C  C210  1  0.465019  0.189943  0.608496  1
  C  C211  1  0.965018  0.188506  0.605954  1
  C  C212  1  0.429673  0.247755  0.565292  1
  C  C213  1  0.929622  0.246523  0.563061  1
  C  C214  1  0.114489  0.476737  0.885682  1
  C  C215  1  0.612980  0.479569  0.886987  1
  C  C216  1  0.444094  0.613888  0.472773  1
  C  C217  1  0.944074  0.614579  0.474443  1
  C  C218  1  0.373408  0.226844  0.678702  1
  C  C219  1  0.873326  0.224937  0.676262  1
  C  C220  1  0.352426  0.465542  0.817251  1
  C  C221  1  0.851686  0.463132  0.815831  1
  C  C222  1  0.400979  0.760765  0.747852  1
  C  C223  1  0.900979  0.760765  0.747852  1
  C  C224  1  0.398912  0.150556  0.387268  1
  C  C225  1  0.898912  0.150556  0.387268  1
  C  C226  1  0.371297  0.497232  0.247852  1
  C  C227  1  0.872005  0.499841  0.248936  1
  C  C228  1  0.352426  0.535034  0.317251  1
  C  C229  1  0.852593  0.536939  0.318357  1
  C  C230  1  0.352426  0.465542  0.678453  1
  C  C231  1  0.852193  0.463745  0.677423  1
  C  C232  1  0.145046  0.538573  0.179104  1
  C  C233  1  0.647923  0.535034  0.178453  1
  C  C234  1  0.372675  0.269943  0.608482  1
  C  C235  1  0.872590  0.268476  0.606302  1
  C  C236  1  0.387369  0.521007  0.108716  1
  C  C237  1  0.889982  0.525496  0.109955  1
  C  C238  1  0.147756  0.536939  0.318357  1
  C  C239  1  0.647923  0.535034  0.317251  1
  C  C240  1  0.376941  0.273732  0.178702  1
  C  C241  1  0.876941  0.273732  0.178702  1
  C  C242  1  0.377674  0.230633  0.387221  1
  C  C243  1  0.877674  0.230633  0.387221  1
  C  C244  1  0.319835  0.323226  0.317020  1
  C  C245  1  0.819835  0.323226  0.317020  1
  C  C246  1  0.127881  0.267136  0.884908  1
  C  C247  1  0.627674  0.269943  0.887221  1
  C  C248  1  0.428802  0.448183  0.247852  1
  C  C249  1  0.928578  0.449214  0.249596  1
  C  C250  1  0.387369  0.479569  0.608716  1
  C  C251  1  0.887095  0.478202  0.607722  1
  C  C252  1  0.113301  0.406538  0.563916  1
  C  C253  1  0.613104  0.407680  0.565229  1
  C  C254  1  0.419673  0.115241  0.317143  1
  C  C255  1  0.919673  0.115241  0.317143  1
  C  C256  1  0.430514  0.823226  0.178684  1
  C  C257  1  0.930460  0.826188  0.182478  1
  C  C258  1  0.371297  0.503343  0.747852  1
  C  C259  1  0.871129  0.501407  0.746776  1
  C  C260  1  0.327752  0.341197  0.747852  1
  C  C261  1  0.827405  0.338840  0.745911  1
  C  C262  1  0.170216  0.382611  0.815410  1
  C  C263  1  0.669673  0.385334  0.817143  1
  C  C264  1  0.069867  0.174956  0.814361  1
  C  C265  1  0.569835  0.177350  0.817020  1
  C  C266  1  0.351437  0.350020  0.608436  1
  C  C267  1  0.851255  0.348522  0.606714  1
  C  C268  1  0.056339  0.526678  0.607558  1
  C  C269  1  0.556031  0.527970  0.607933  1
  C  C270  1  0.376941  0.726844  0.817002  1
  C  C271  1  0.876941  0.726844  0.817002  1
  C  C272  1  0.465019  0.189943  0.887207  1
  C  C273  1  0.964997  0.187479  0.884587  1
  C  C274  1  0.464761  0.438826  0.317325  1
  C  C275  1  0.964795  0.439082  0.318959  1
  C  C276  1  0.056490  0.471865  0.108606  1
  C  C277  1  0.556031  0.472606  0.107933  1
  C  C278  1  0.285330  0.310633  0.387207  1
  C  C279  1  0.785330  0.310633  0.387207  1
  C  C280  1  0.137245  0.092896  0.430474  1
  C  C281  1  0.637245  0.092896  0.430474  1
  C  C282  1  0.285588  0.061749  0.817325  1
  C  C283  1  0.785588  0.061749  0.817325  1
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