# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   23.34191293
_cell_length_b   19.50953532
_cell_length_c   20.13589875
_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   9169.68440954
_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  0.386918  0.593019  0.431416  1
  C  C2  1  0.887074  0.593228  0.431765  1
  C  C3  1  0.035449  0.561788  0.818355  1
  C  C4  1  0.536054  0.562180  0.818110  1
  C  C5  1  0.376791  0.726609  0.679574  1
  C  C6  1  0.876791  0.726609  0.679574  1
  C  C7  1  0.099239  0.240213  0.248856  1
  C  C8  1  0.599239  0.240213  0.248856  1
  C  C9  1  0.113009  0.593228  0.431765  1
  C  C10  1  0.612853  0.593467  0.431762  1
  C  C11  1  0.464820  0.811057  0.109058  1
  C  C12  1  0.964894  0.811023  0.109234  1
  C  C13  1  0.330435  0.615321  0.317842  1
  C  C14  1  0.830489  0.615610  0.318270  1
  C  C15  1  0.000041  0.561975  0.012592  1
  C  C16  1  0.500428  0.562108  0.012435  1
  C  C17  1  0.351427  0.650736  0.108814  1
  C  C18  1  0.851279  0.650938  0.109194  1
  C  C19  1  0.035188  0.189722  0.609234  1
  C  C20  1  0.535529  0.189577  0.609149  1
  C  C21  1  0.035475  0.694510  0.024017  1
  C  C22  1  0.535662  0.694715  0.023914  1
  C  C23  1  0.035449  0.561788  0.679357  1
  C  C24  1  0.535843  0.562094  0.679077  1
  C  C25  1  0.113009  0.407517  0.931765  1
  C  C26  1  0.613766  0.408009  0.931602  1
  C  C27  1  0.056110  0.614229  0.023685  1
  C  C28  1  0.556411  0.614475  0.023601  1
  C  C29  1  0.148803  0.349807  0.888518  1
  C  C30  1  0.649288  0.350111  0.888254  1
  C  C31  1  0.372583  0.730857  0.108887  1
  C  C32  1  0.872550  0.731015  0.109223  1
  C  C33  1  0.428996  0.553302  0.748784  1
  C  C34  1  0.928535  0.552373  0.748856  1
  C  C35  1  0.071547  0.448372  0.248856  1
  C  C36  1  0.571694  0.448608  0.248778  1
  C  C37  1  0.464794  0.694567  0.023827  1
  C  C38  1  0.964607  0.694510  0.024017  1
  C  C39  1  0.148803  0.349807  0.609194  1
  C  C40  1  0.648934  0.349877  0.608685  1
  C  C41  1  0.056110  0.614229  0.474027  1
  C  C42  1  0.555871  0.614391  0.473907  1
  C  C43  1  0.035449  0.438956  0.318355  1
  C  C44  1  0.535541  0.439114  0.318228  1
  C  C45  1  0.422498  0.840962  0.748856  1
  C  C46  1  0.922498  0.840962  0.748856  1
  C  C47  1  0.147888  0.465374  0.679361  1
  C  C48  1  0.648071  0.465346  0.678950  1
  C  C49  1  0.465233  0.562362  0.818190  1
  C  C50  1  0.964633  0.561788  0.818355  1
  C  C51  1  0.000041  0.485722  0.058383  1
  C  C52  1  0.500385  0.485787  0.058132  1
  C  C53  1  0.320541  0.253202  0.431754  1
  C  C54  1  0.820541  0.253202  0.431754  1
  C  C55  1  0.112922  0.521320  0.109513  1
  C  C56  1  0.613164  0.521638  0.109515  1
  C  C57  1  0.071547  0.552373  0.748856  1
  C  C58  1  0.572007  0.552644  0.748526  1
  C  C59  1  0.123291  0.274136  0.318138  1
  C  C60  1  0.623291  0.274136  0.318138  1
  C  C61  1  0.431518  0.244866  0.929719  1
  C  C62  1  0.929541  0.247543  0.931754  1
  C  C63  1  0.123291  0.274136  0.179574  1
  C  C64  1  0.623291  0.274136  0.179574  1
  C  C65  1  0.035475  0.306235  0.973696  1
  C  C66  1  0.536189  0.306606  0.973262  1
  C  C67  1  0.443978  0.386586  0.524168  1
  C  C68  1  0.943972  0.386515  0.523685  1
  C  C69  1  0.112922  0.521320  0.388200  1
  C  C70  1  0.612837  0.521565  0.388187  1
  C  C71  1  0.320541  0.253202  0.065958  1
  C  C72  1  0.820541  0.253202  0.065958  1
  C  C73  1  0.129001  0.503248  0.748856  1
  C  C74  1  0.629373  0.503381  0.748441  1
  C  C75  1  0.035188  0.189722  0.888479  1
  C  C76  1  0.535573  0.187374  0.891314  1
  C  C77  1  0.035449  0.438956  0.179357  1
  C  C78  1  0.535690  0.439151  0.179218  1
  C  C79  1  0.444299  0.528247  0.608884  1
  C  C80  1  0.944098  0.527833  0.608891  1
  C  C81  1  0.464255  0.694459  0.473491  1
  C  C82  1  0.964607  0.694510  0.473696  1
  C  C83  1  0.000041  0.515023  0.558383  1
  C  C84  1  0.500098  0.515178  0.558265  1
  C  C85  1  0.352776  0.350078  0.887198  1
  C  C86  1  0.851279  0.349807  0.888518  1
  C  C87  1  0.464438  0.840607  0.248683  1
  C  C88  1  0.964716  0.840610  0.248856  1
  C  C89  1  0.372255  0.730796  0.388147  1
  C  C90  1  0.872550  0.731015  0.388490  1
  C  C91  1  0.147888  0.465374  0.818352  1
  C  C92  1  0.648312  0.465512  0.817924  1
  C  C93  1  0.444959  0.386113  0.972952  1
  C  C94  1  0.943972  0.386515  0.974027  1
  C  C95  1  0.055984  0.527833  0.888821  1
  C  C96  1  0.556614  0.528205  0.888556  1
  C  C97  1  0.169593  0.385134  0.679442  1
  C  C98  1  0.669557  0.385062  0.679050  1
  C  C99  1  0.444386  0.472740  0.108498  1
  C  C100  1  0.944098  0.472911  0.108891  1
  C  C101  1  0.035475  0.694510  0.473696  1
  C  C102  1  0.535122  0.694630  0.473597  1
  C  C103  1  0.285366  0.340610  0.248856  1
  C  C104  1  0.785366  0.340610  0.248856  1
  C  C105  1  0.000041  0.438770  0.985120  1
  C  C106  1  0.500772  0.438996  0.984784  1
  C  C107  1  0.444076  0.472725  0.388624  1
  C  C108  1  0.944098  0.472911  0.388821  1
  C  C109  1  0.351100  0.650675  0.388127  1
  C  C110  1  0.851279  0.650938  0.388518  1
  C  C111  1  0.930390  0.177119  0.818157  1
  C  C112  1  0.000041  0.561975  0.485120  1
  C  C113  1  0.499878  0.562003  0.484922  1
  C  C114  1  0.000041  0.438770  0.512592  1
  C  C115  1  0.499978  0.438864  0.512546  1
  C  C116  1  0.330599  0.615346  0.179017  1
  C  C117  1  0.830489  0.615610  0.179442  1
  C  C118  1  0.469062  0.148884  0.740439  1
  C  C119  1  0.964716  0.160134  0.748856  1
  C  C120  1  0.464596  0.306425  0.524870  1
  C  C121  1  0.964607  0.306235  0.524017  1
  C  C122  1  0.464492  0.810991  0.388297  1
  C  C123  1  0.964894  0.811023  0.388479  1
  C  C124  1  0.113009  0.593228  0.065947  1
  C  C125  1  0.613279  0.593548  0.065952  1
  C  C126  1  0.329643  0.386683  0.679816  1
  C  C127  1  0.830489  0.385134  0.679442  1
  C  C128  1  0.352991  0.228643  0.821516  1
  C  C129  1  0.873291  0.226609  0.818138  1
  C  C130  1  0.430898  0.175977  0.682055  1
  C  C131  1  0.930390  0.177119  0.679555  1
  C  C132  1  0.387346  0.593092  0.065623  1
  C  C133  1  0.887074  0.593228  0.065947  1
  C  C134  1  0.387800  0.407312  0.930620  1
  C  C135  1  0.887074  0.407517  0.931765  1
  C  C136  1  0.285188  0.311023  0.109234  1
  C  C137  1  0.785188  0.311023  0.109234  1
  C  C138  1  0.055984  0.472911  0.388821  1
  C  C139  1  0.555939  0.473089  0.388739  1
  C  C140  1  0.056110  0.386515  0.974027  1
  C  C141  1  0.556953  0.387242  0.973954  1
  C  C142  1  0.464875  0.438937  0.179053  1
  C  C143  1  0.964633  0.438956  0.179357  1
  C  C144  1  0.070541  0.247543  0.565958  1
  C  C145  1  0.570944  0.247859  0.565392  1
  C  C146  1  0.422498  0.159783  0.248856  1
  C  C147  1  0.922498  0.159783  0.248856  1
  C  C148  1  0.327554  0.659502  0.248433  1
  C  C149  1  0.827584  0.659783  0.248856  1
  C  C150  1  0.430052  0.823539  0.317924  1
  C  C151  1  0.930390  0.823626  0.318157  1
  C  C152  1  0.419593  0.115610  0.179442  1
  C  C153  1  0.919593  0.115610  0.179442  1
  C  C154  1  0.127533  0.269730  0.609223  1
  C  C155  1  0.627760  0.269830  0.608393  1
  C  C156  1  0.319692  0.323626  0.179555  1
  C  C157  1  0.819692  0.323626  0.179555  1
  C  C158  1  0.377533  0.231015  0.109223  1
  C  C159  1  0.877533  0.231015  0.109223  1
  C  C160  1  0.376791  0.274136  0.318138  1
  C  C161  1  0.876791  0.274136  0.318138  1
  C  C162  1  0.387122  0.521105  0.387861  1
  C  C163  1  0.887160  0.521320  0.388200  1
  C  C164  1  0.035366  0.160134  0.748856  1
  C  C165  1  0.535789  0.156558  0.748391  1
  C  C166  1  0.387652  0.480140  0.888029  1
  C  C167  1  0.887160  0.479425  0.888200  1
  C  C168  1  0.371412  0.267895  0.885411  1
  C  C169  1  0.872550  0.269730  0.888490  1
  C  C170  1  0.344068  0.260091  0.750135  1
  C  C171  1  0.849239  0.260531  0.748856  1
  C  C172  1  0.056110  0.386515  0.523685  1
  C  C173  1  0.556108  0.386720  0.523428  1
  C  C174  1  0.070541  0.247543  0.931754  1
  C  C175  1  0.572250  0.248077  0.933149  1
  C  C176  1  0.465016  0.562347  0.679222  1
  C  C177  1  0.964633  0.561788  0.679357  1
  C  C178  1  0.429163  0.753095  0.431505  1
  C  C179  1  0.929541  0.753202  0.431754  1
  C  C180  1  0.352400  0.535144  0.178936  1
  C  C181  1  0.852194  0.535371  0.179361  1
  C  C182  1  0.387195  0.407557  0.566815  1
  C  C183  1  0.887074  0.407517  0.565947  1
  C  C184  1  0.129001  0.497496  0.248856  1
  C  C185  1  0.629103  0.497807  0.248871  1
  C  C186  1  0.398803  0.150938  0.109194  1
  C  C187  1  0.898803  0.150938  0.109194  1
  C  C188  1  0.400843  0.240213  0.248856  1
  C  C189  1  0.900843  0.240213  0.248856  1
  C  C190  1  0.330494  0.386522  0.818226  1
  C  C191  1  0.830489  0.385134  0.818270  1
  C  C192  1  0.000041  0.515023  0.939330  1
  C  C193  1  0.500681  0.515302  0.939089  1
  C  C194  1  0.444277  0.614243  0.023490  1
  C  C195  1  0.943972  0.614229  0.023685  1
  C  C196  1  0.429591  0.753180  0.065717  1
  C  C197  1  0.929541  0.753202  0.065958  1
  C  C198  1  0.069692  0.177119  0.679555  1
  C  C199  1  0.571099  0.176180  0.678048  1
  C  C200  1  0.465465  0.306480  0.971147  1
  C  C201  1  0.964607  0.306235  0.973696  1
  C  C202  1  0.000041  0.485722  0.439330  1
  C  C203  1  0.499938  0.485703  0.439210  1
  C  C204  1  0.112922  0.479425  0.609513  1
  C  C205  1  0.613074  0.479524  0.609124  1
  C  C206  1  0.035475  0.306235  0.524017  1
  C  C207  1  0.535458  0.306358  0.523919  1
  C  C208  1  0.444739  0.528282  0.888638  1
  C  C209  1  0.944098  0.527833  0.888821  1
  C  C210  1  0.465583  0.190328  0.609646  1
  C  C211  1  0.964894  0.189722  0.609234  1
  C  C212  1  0.430216  0.247789  0.567954  1
  C  C213  1  0.929541  0.247543  0.565958  1
  C  C214  1  0.112922  0.479425  0.888200  1
  C  C215  1  0.613564  0.479852  0.887846  1
  C  C216  1  0.443739  0.614134  0.473764  1
  C  C217  1  0.943972  0.614229  0.474027  1
  C  C218  1  0.373881  0.227560  0.682217  1
  C  C219  1  0.873291  0.226609  0.679574  1
  C  C220  1  0.352362  0.467133  0.818484  1
  C  C221  1  0.852194  0.465374  0.818352  1
  C  C222  1  0.400843  0.760531  0.748856  1
  C  C223  1  0.900843  0.760531  0.748856  1
  C  C224  1  0.398803  0.150938  0.388518  1
  C  C225  1  0.898803  0.150938  0.388518  1
  C  C226  1  0.371238  0.497304  0.248467  1
  C  C227  1  0.871082  0.497496  0.248856  1
  C  C228  1  0.352236  0.535119  0.317951  1
  C  C229  1  0.852194  0.535371  0.318352  1
  C  C230  1  0.352023  0.467019  0.679422  1
  C  C231  1  0.852194  0.465374  0.679361  1
  C  C232  1  0.147888  0.535371  0.179361  1
  C  C233  1  0.648040  0.535726  0.179417  1
  C  C234  1  0.373383  0.270180  0.612949  1
  C  C235  1  0.872550  0.269730  0.609223  1
  C  C236  1  0.387447  0.521148  0.109132  1
  C  C237  1  0.887160  0.521320  0.109513  1
  C  C238  1  0.147888  0.535371  0.318352  1
  C  C239  1  0.647875  0.535694  0.318402  1
  C  C240  1  0.376791  0.274136  0.179574  1
  C  C241  1  0.876791  0.274136  0.179574  1
  C  C242  1  0.377533  0.231015  0.388490  1
  C  C243  1  0.877533  0.231015  0.388490  1
  C  C244  1  0.319692  0.323626  0.318157  1
  C  C245  1  0.819692  0.323626  0.318157  1
  C  C246  1  0.127533  0.269730  0.888490  1
  C  C247  1  0.627597  0.270071  0.888702  1
  C  C248  1  0.428748  0.448275  0.248542  1
  C  C249  1  0.928535  0.448372  0.248856  1
  C  C250  1  0.387223  0.480035  0.609754  1
  C  C251  1  0.887160  0.479425  0.609513  1
  C  C252  1  0.113009  0.407517  0.565947  1
  C  C253  1  0.613089  0.407673  0.565499  1
  C  C254  1  0.419593  0.115610  0.318270  1
  C  C255  1  0.919593  0.115610  0.318270  1
  C  C256  1  0.430214  0.823571  0.179326  1
  C  C257  1  0.930390  0.823626  0.179555  1
  C  C258  1  0.371163  0.504660  0.748868  1
  C  C259  1  0.871082  0.503248  0.748856  1
  C  C260  1  0.325298  0.343548  0.748909  1
  C  C261  1  0.827584  0.340962  0.748856  1
  C  C262  1  0.169593  0.385134  0.818270  1
  C  C263  1  0.669773  0.385174  0.817886  1
  C  C264  1  0.069692  0.177119  0.818157  1
  C  C265  1  0.568852  0.177564  0.818866  1
  C  C266  1  0.351673  0.350260  0.610386  1
  C  C267  1  0.851279  0.349807  0.609194  1
  C  C268  1  0.055984  0.527833  0.608891  1
  C  C269  1  0.556164  0.527977  0.608611  1
  C  C270  1  0.376791  0.726609  0.818138  1
  C  C271  1  0.876791  0.726609  0.818138  1
  C  C272  1  0.469535  0.183622  0.906935  1
  C  C273  1  0.964894  0.189722  0.888479  1
  C  C274  1  0.464726  0.438921  0.318133  1
  C  C275  1  0.964633  0.438956  0.318355  1
  C  C276  1  0.055984  0.472911  0.108891  1
  C  C277  1  0.556258  0.473179  0.108799  1
  C  C278  1  0.285188  0.311023  0.388479  1
  C  C279  1  0.785188  0.311023  0.388479  1
  C  C280  1  0.137074  0.093228  0.431765  1
  C  C281  1  0.637074  0.093228  0.431765  1
  C  C282  1  0.285449  0.061788  0.818355  1
  C  C283  1  0.785449  0.061788  0.818355  1
  C  C284  1  0.126791  0.226609  0.679574  1
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