# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   39.50945245
_cell_length_b   29.69001184
_cell_length_c   48.22354801
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   69.23515003
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C2016
_cell_volume   52893.4980014
_cell_formula_units_Z   2016
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  0.267085  0.910959  0.279532  1
  C  C2  1  0.267085  0.410959  0.279532  1
  C  C3  1  0.767085  0.910959  0.279532  1
  C  C4  1  0.767085  0.410959  0.279532  1
  C  C5  1  0.017085  0.910959  0.279532  1
  C  C6  1  0.017085  0.410959  0.279532  1
  C  C7  1  0.517085  0.910959  0.279532  1
  C  C8  1  0.517085  0.410959  0.279532  1
  C  C9  1  0.090017  0.879417  0.300424  1
  C  C10  1  0.090017  0.379417  0.300424  1
  C  C11  1  0.590017  0.879417  0.300424  1
  C  C12  1  0.590017  0.379417  0.300424  1
  C  C13  1  0.183752  0.744292  0.279532  1
  C  C14  1  0.183752  0.244292  0.279532  1
  C  C15  1  0.683752  0.744292  0.279532  1
  C  C16  1  0.683752  0.244292  0.279532  1
  C  C17  1  0.161111  0.845182  0.323099  1
  C  C18  1  0.161111  0.345182  0.323099  1
  C  C19  1  0.661111  0.845182  0.323099  1
  C  C20  1  0.661111  0.345182  0.323099  1
  C  C21  1  0.256683  0.712750  0.300424  1
  C  C22  1  0.256683  0.212750  0.300424  1
  C  C23  1  0.756683  0.712750  0.300424  1
  C  C24  1  0.756683  0.212750  0.300424  1
  C  C25  1  0.840017  0.879417  0.300424  1
  C  C26  1  0.840017  0.379417  0.300424  1
  C  C27  1  0.340017  0.879417  0.300424  1
  C  C28  1  0.340017  0.379417  0.300424  1
  C  C29  1  0.933752  0.744292  0.279532  1
  C  C30  1  0.933752  0.244292  0.279532  1
  C  C31  1  0.433752  0.744292  0.279532  1
  C  C32  1  0.433752  0.244292  0.279532  1
  C  C33  1  0.911111  0.845182  0.323099  1
  C  C34  1  0.911111  0.345182  0.323099  1
  C  C35  1  0.411111  0.845182  0.323099  1
  C  C36  1  0.411111  0.345182  0.323099  1
  C  C37  1  0.006683  0.712750  0.300424  1
  C  C38  1  0.006683  0.212750  0.300424  1
  C  C39  1  0.506683  0.712750  0.300424  1
  C  C40  1  0.506683  0.212750  0.300424  1
  C  C41  1  0.100418  0.577625  0.279532  1
  C  C42  1  0.100418  0.077625  0.279532  1
  C  C43  1  0.600418  0.577625  0.279532  1
  C  C44  1  0.600418  0.077625  0.279532  1
  C  C45  1  0.077778  0.678516  0.323099  1
  C  C46  1  0.077778  0.178516  0.323099  1
  C  C47  1  0.577778  0.678516  0.323099  1
  C  C48  1  0.577778  0.178516  0.323099  1
  C  C49  1  0.173350  0.546084  0.300424  1
  C  C50  1  0.173350  0.046084  0.300424  1
  C  C51  1  0.673350  0.546084  0.300424  1
  C  C52  1  0.673350  0.046084  0.300424  1
  C  C53  1  0.244445  0.511849  0.323099  1
  C  C54  1  0.244445  0.011849  0.323099  1
  C  C55  1  0.744445  0.511849  0.323099  1
  C  C56  1  0.744445  0.011849  0.323099  1
  C  C57  1  0.850418  0.577625  0.279532  1
  C  C58  1  0.850418  0.077625  0.279532  1
  C  C59  1  0.350418  0.577625  0.279532  1
  C  C60  1  0.350418  0.077625  0.279532  1
  C  C61  1  0.827778  0.678516  0.323099  1
  C  C62  1  0.827778  0.178516  0.323099  1
  C  C63  1  0.327778  0.678516  0.323099  1
  C  C64  1  0.327778  0.178516  0.323099  1
  C  C65  1  0.923350  0.546084  0.300424  1
  C  C66  1  0.923350  0.046084  0.300424  1
  C  C67  1  0.423350  0.546084  0.300424  1
  C  C68  1  0.423350  0.046084  0.300424  1
  C  C69  1  0.994445  0.511849  0.323099  1
  C  C70  1  0.994445  0.011849  0.323099  1
  C  C71  1  0.494445  0.511849  0.323099  1
  C  C72  1  0.494445  0.011849  0.323099  1
  C  C73  1  0.255888  0.046084  0.300424  1
  C  C74  1  0.255888  0.546084  0.300424  1
  C  C75  1  0.755888  0.046084  0.300424  1
  C  C76  1  0.755888  0.546084  0.300424  1
  C  C77  1  0.005888  0.046084  0.300424  1
  C  C78  1  0.005888  0.546084  0.300424  1
  C  C79  1  0.505888  0.046084  0.300424  1
  C  C80  1  0.505888  0.546084  0.300424  1
  C  C81  1  0.078034  0.011849  0.323099  1
  C  C82  1  0.078034  0.511849  0.323099  1
  C  C83  1  0.578035  0.011849  0.323099  1
  C  C84  1  0.578034  0.511849  0.323099  1
  C  C85  1  0.172554  0.879417  0.300424  1
  C  C86  1  0.172554  0.379417  0.300424  1
  C  C87  1  0.672554  0.879417  0.300424  1
  C  C88  1  0.672554  0.379417  0.300424  1
  C  C89  1  0.187013  0.077625  0.279532  1
  C  C90  1  0.187013  0.577625  0.279532  1
  C  C91  1  0.687013  0.077625  0.279532  1
  C  C92  1  0.687013  0.577625  0.279532  1
  C  C93  1  0.244701  0.845182  0.323099  1
  C  C94  1  0.244701  0.345182  0.323099  1
  C  C95  1  0.744701  0.845182  0.323099  1
  C  C96  1  0.744701  0.345182  0.323099  1
  C  C97  1  0.828034  0.011849  0.323099  1
  C  C98  1  0.828034  0.511849  0.323099  1
  C  C99  1  0.328035  0.011849  0.323099  1
  C  C100  1  0.328034  0.511849  0.323099  1
  C  C101  1  0.922554  0.879417  0.300424  1
  C  C102  1  0.922554  0.379417  0.300424  1
  C  C103  1  0.422554  0.879417  0.300424  1
  C  C104  1  0.422554  0.379417  0.300424  1
  C  C105  1  0.937013  0.077625  0.279532  1
  C  C106  1  0.937013  0.577625  0.279532  1
  C  C107  1  0.437013  0.077625  0.279532  1
  C  C108  1  0.437013  0.577625  0.279532  1
  C  C109  1  0.994701  0.845182  0.323099  1
  C  C110  1  0.994701  0.345182  0.323099  1
  C  C111  1  0.494701  0.845182  0.323099  1
  C  C112  1  0.494701  0.345182  0.323099  1
  C  C113  1  0.089221  0.712750  0.300424  1
  C  C114  1  0.089221  0.212750  0.300424  1
  C  C115  1  0.589221  0.712750  0.300424  1
  C  C116  1  0.589221  0.212750  0.300424  1
  C  C117  1  0.103680  0.910959  0.279532  1
  C  C118  1  0.103680  0.410959  0.279532  1
  C  C119  1  0.603680  0.910958  0.279532  1
  C  C120  1  0.603680  0.410958  0.279532  1
  C  C121  1  0.161368  0.678516  0.323099  1
  C  C122  1  0.161368  0.178516  0.323099  1
  C  C123  1  0.661368  0.678516  0.323099  1
  C  C124  1  0.661368  0.178516  0.323099  1
  C  C125  1  0.270346  0.744292  0.279532  1
  C  C126  1  0.270346  0.244292  0.279532  1
  C  C127  1  0.770346  0.744292  0.279532  1
  C  C128  1  0.770346  0.244292  0.279532  1
  C  C129  1  0.839221  0.712750  0.300424  1
  C  C130  1  0.839221  0.212750  0.300424  1
  C  C131  1  0.339221  0.712750  0.300424  1
  C  C132  1  0.339221  0.212750  0.300424  1
  C  C133  1  0.853680  0.910959  0.279532  1
  C  C134  1  0.853680  0.410959  0.279532  1
  C  C135  1  0.353680  0.910958  0.279532  1
  C  C136  1  0.353680  0.410958  0.279532  1
  C  C137  1  0.911368  0.678516  0.323099  1
  C  C138  1  0.911368  0.178516  0.323099  1
  C  C139  1  0.411368  0.678516  0.323099  1
  C  C140  1  0.411368  0.178516  0.323099  1
  C  C141  1  0.020346  0.744292  0.279532  1
  C  C142  1  0.020346  0.244292  0.279532  1
  C  C143  1  0.520346  0.744292  0.279532  1
  C  C144  1  0.520346  0.244292  0.279532  1
  C  C145  1  0.286111  0.845182  0.323099  1
  C  C146  1  0.286111  0.345182  0.323099  1
  C  C147  1  0.786111  0.845182  0.323099  1
  C  C148  1  0.786111  0.345182  0.323099  1
  C  C149  1  0.036111  0.845182  0.323099  1
  C  C150  1  0.036111  0.345182  0.323099  1
  C  C151  1  0.536111  0.845182  0.323099  1
  C  C152  1  0.536111  0.345182  0.323099  1
  C  C153  1  0.142085  0.910959  0.279532  1
  C  C154  1  0.142085  0.410959  0.279532  1
  C  C155  1  0.642085  0.910959  0.279532  1
  C  C156  1  0.642085  0.410959  0.279532  1
  C  C157  1  0.202778  0.678516  0.323099  1
  C  C158  1  0.202778  0.178516  0.323099  1
  C  C159  1  0.702778  0.678516  0.323099  1
  C  C160  1  0.702778  0.178516  0.323099  1
  C  C161  1  0.215017  0.879417  0.300424  1
  C  C162  1  0.215017  0.379417  0.300424  1
  C  C163  1  0.715017  0.879417  0.300424  1
  C  C164  1  0.715017  0.379417  0.300424  1
  C  C165  1  0.308752  0.744292  0.279532  1
  C  C166  1  0.308752  0.244292  0.279532  1
  C  C167  1  0.808752  0.744292  0.279532  1
  C  C168  1  0.808752  0.244292  0.279532  1
  C  C169  1  0.892085  0.910959  0.279532  1
  C  C170  1  0.892085  0.410959  0.279532  1
  C  C171  1  0.392085  0.910959  0.279532  1
  C  C172  1  0.392085  0.410959  0.279532  1
  C  C173  1  0.952778  0.678516  0.323099  1
  C  C174  1  0.952778  0.178516  0.323099  1
  C  C175  1  0.452778  0.678516  0.323099  1
  C  C176  1  0.452778  0.178516  0.323099  1
  C  C177  1  0.965017  0.879417  0.300424  1
  C  C178  1  0.965017  0.379417  0.300424  1
  C  C179  1  0.465017  0.879417  0.300424  1
  C  C180  1  0.465017  0.379417  0.300424  1
  C  C181  1  0.058752  0.744292  0.279532  1
  C  C182  1  0.058752  0.244292  0.279532  1
  C  C183  1  0.558752  0.744292  0.279532  1
  C  C184  1  0.558752  0.244292  0.279532  1
  C  C185  1  0.119445  0.511849  0.323099  1
  C  C186  1  0.119445  0.011849  0.323099  1
  C  C187  1  0.619445  0.511849  0.323099  1
  C  C188  1  0.619445  0.011849  0.323099  1
  C  C189  1  0.131683  0.712750  0.300424  1
  C  C190  1  0.131683  0.212750  0.300424  1
  C  C191  1  0.631683  0.712750  0.300424  1
  C  C192  1  0.631683  0.212750  0.300424  1
  C  C193  1  0.225418  0.577625  0.279532  1
  C  C194  1  0.225418  0.077625  0.279532  1
  C  C195  1  0.725418  0.577625  0.279532  1
  C  C196  1  0.725418  0.077625  0.279532  1
  C  C197  1  0.298350  0.546084  0.300424  1
  C  C198  1  0.298350  0.046084  0.300424  1
  C  C199  1  0.798350  0.546084  0.300424  1
  C  C200  1  0.798350  0.046084  0.300424  1
  C  C201  1  0.869445  0.511849  0.323099  1
  C  C202  1  0.869445  0.011849  0.323099  1
  C  C203  1  0.369445  0.511849  0.323099  1
  C  C204  1  0.369445  0.011849  0.323099  1
  C  C205  1  0.881683  0.712750  0.300424  1
  C  C206  1  0.881683  0.212750  0.300424  1
  C  C207  1  0.381683  0.712750  0.300424  1
  C  C208  1  0.381683  0.212750  0.300424  1
  C  C209  1  0.975418  0.577625  0.279532  1
  C  C210  1  0.975418  0.077625  0.279532  1
  C  C211  1  0.475418  0.577625  0.279532  1
  C  C212  1  0.475418  0.077625  0.279532  1
  C  C213  1  0.048350  0.546084  0.300424  1
  C  C214  1  0.048350  0.046084  0.300424  1
  C  C215  1  0.548350  0.546084  0.300424  1
  C  C216  1  0.548350  0.046084  0.300424  1
  C  C217  1  0.312013  0.077625  0.279532  1
  C  C218  1  0.312013  0.577625  0.279532  1
  C  C219  1  0.812013  0.077625  0.279532  1
  C  C220  1  0.812013  0.577625  0.279532  1
  C  C221  1  0.062013  0.077625  0.279532  1
  C  C222  1  0.062013  0.577625  0.279532  1
  C  C223  1  0.562013  0.077625  0.279532  1
  C  C224  1  0.562013  0.577625  0.279532  1
  C  C225  1  0.130888  0.046084  0.300424  1
  C  C226  1  0.130888  0.546084  0.300424  1
  C  C227  1  0.630888  0.046084  0.300424  1
  C  C228  1  0.630888  0.546084  0.300424  1
  C  C229  1  0.228680  0.910958  0.279532  1
  C  C230  1  0.228680  0.410959  0.279532  1
  C  C231  1  0.728680  0.910959  0.279532  1
  C  C232  1  0.728680  0.410958  0.279532  1
  C  C233  1  0.203034  0.011849  0.323099  1
  C  C234  1  0.203034  0.511849  0.323099  1
  C  C235  1  0.703035  0.011849  0.323099  1
  C  C236  1  0.703034  0.511849  0.323099  1
  C  C237  1  0.297554  0.879417  0.300424  1
  C  C238  1  0.297554  0.379417  0.300424  1
  C  C239  1  0.797554  0.879417  0.300424  1
  C  C240  1  0.797554  0.379417  0.300424  1
  C  C241  1  0.880888  0.046084  0.300424  1
  C  C242  1  0.880888  0.546084  0.300424  1
  C  C243  1  0.380888  0.046084  0.300424  1
  C  C244  1  0.380888  0.546084  0.300424  1
  C  C245  1  0.978680  0.910959  0.279532  1
  C  C246  1  0.978680  0.410959  0.279532  1
  C  C247  1  0.478680  0.910958  0.279532  1
  C  C248  1  0.478680  0.410958  0.279532  1
  C  C249  1  0.953034  0.011849  0.323099  1
  C  C250  1  0.953034  0.511849  0.323099  1
  C  C251  1  0.453035  0.011849  0.323099  1
  C  C252  1  0.453035  0.511849  0.323099  1
  C  C253  1  0.047554  0.879417  0.300424  1
  C  C254  1  0.047554  0.379417  0.300424  1
  C  C255  1  0.547554  0.879417  0.300424  1
  C  C256  1  0.547554  0.379417  0.300424  1
  C  C257  1  0.145346  0.744292  0.279532  1
  C  C258  1  0.145346  0.244292  0.279532  1
  C  C259  1  0.645346  0.744292  0.279532  1
  C  C260  1  0.645346  0.244292  0.279532  1
  C  C261  1  0.119701  0.845182  0.323099  1
  C  C262  1  0.119701  0.345182  0.323099  1
  C  C263  1  0.619701  0.845182  0.323099  1
  C  C264  1  0.619701  0.345182  0.323099  1
  C  C265  1  0.214221  0.712750  0.300424  1
  C  C266  1  0.214221  0.212750  0.300424  1
  C  C267  1  0.714221  0.712750  0.300424  1
  C  C268  1  0.714221  0.212750  0.300424  1
  C  C269  1  0.286368  0.678516  0.323099  1
  C  C270  1  0.286368  0.178516  0.323099  1
  C  C271  1  0.786368  0.678516  0.323099  1
  C  C272  1  0.786368  0.178516  0.323099  1
  C  C273  1  0.895346  0.744292  0.279532  1
  C  C274  1  0.895346  0.244292  0.279532  1
  C  C275  1  0.395346  0.744292  0.279532  1
  C  C276  1  0.395346  0.244292  0.279532  1
  C  C277  1  0.869701  0.845182  0.323099  1
  C  C278  1  0.869701  0.345182  0.323099  1
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  C  C2008  1  0.157040  0.741485  0.722925  1
  C  C2009  1  0.750775  0.106360  0.702034  1
  C  C2010  1  0.750775  0.606360  0.702034  1
  C  C2011  1  0.250775  0.106360  0.702034  1
  C  C2012  1  0.250775  0.606360  0.702034  1
  C  C2013  1  0.823707  0.074819  0.722925  1
  C  C2014  1  0.823707  0.574819  0.722925  1
  C  C2015  1  0.323707  0.074819  0.722925  1
  C  C2016  1  0.323707  0.574819  0.722925  1
