# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.55904758
_cell_length_b   4.52303201
_cell_length_c   90.77659788
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   84.26082953
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C117
_cell_volume   1862.49573111
_cell_formula_units_Z   117
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  0.860885  0.337817  0.026289  1
  C  C2  1  0.211013  0.869892  0.021944  1
  C  C3  1  0.565652  0.655613  -0.008124  1
  C  C4  1  0.553008  0.726267  0.027036  1
  C  C5  1  0.815428  0.363677  -0.006979  1
  C  C6  1  0.489099  0.341833  0.001111  1
  C  C7  1  0.323880  0.787801  -0.022432  1
  C  C8  1  0.810191  0.223780  0.009342  1
  C  C9  1  0.435800  0.691742  0.009291  1
  C  C10  1  0.757456  1.099591  0.067212  1
  C  C11  1  0.135322  0.717452  0.071823  1
  C  C12  1  0.203924  0.219806  0.028465  1
  C  C13  1  0.324575  0.423615  0.063390  1
  C  C14  1  0.343916  0.951019  0.039275  1
  C  C15  1  0.476026  1.109183  0.054822  1
  C  C16  1  0.799195  0.585948  0.039992  1
  C  C17  1  0.792197  0.887883  0.051639  1
  C  C18  1  1.007746  0.573010  0.055795  1
  C  C19  1  0.816169  0.886116  0.115118  1
  C  C20  1  1.105209  0.437508  0.103512  1
  C  C21  1  0.995944  1.038119  0.081433  1
  C  C22  1  0.348013  0.142511  0.108679  1
  C  C23  1  0.432566  0.723381  0.082221  1
  C  C24  1  0.286214  0.990194  0.092465  1
  C  C25  1  0.592474  0.393590  0.077142  1
  C  C26  1  0.791609  0.647339  0.102019  1
  C  C27  1  0.846577  0.349614  0.090980  1
  C  C28  1  0.475298  0.815186  0.143408  1
  C  C29  1  0.745038  0.550033  0.148039  1
  C  C30  1  0.957514  1.050422  0.129164  1
  C  C31  1  0.210010  0.267148  0.157108  1
  C  C32  1  0.361344  0.481305  0.116804  1
  C  C33  1  0.128079  0.983173  0.145684  1
  C  C34  1  0.613902  0.185824  0.122011  1
  C  C35  1  0.530144  0.502142  0.132977  1
  C  C36  1  1.038907  0.337634  0.140625  1
  C  C37  1  0.261895  0.790553  0.181616  1
  C  C38  1  0.764182  0.431759  0.193147  1
  C  C39  1  0.682088  0.858854  0.158928  1
  C  C40  1  0.255989  1.012700  0.196828  1
  C  C41  1  0.152699  0.522573  0.170844  1
  C  C42  1  0.929671  0.842313  0.173105  1
  C  C43  1  0.540373  0.191386  0.165474  1
  C  C44  1  0.497217  0.464671  0.179500  1
  C  C45  1  0.748977  0.154082  0.180810  1
  C  C46  1  0.346491  0.649475  0.229191  1
  C  C47  1  0.584688  0.331295  0.226143  1
  C  C48  1  0.865071  0.666799  0.206686  1
  C  C49  1  0.121040  0.126280  0.241704  1
  C  C50  1  1.082901  0.349442  0.202194  1
  C  C51  1  1.019574  0.769160  0.222273  1
  C  C52  1  0.553088  0.886109  0.206025  1
  C  C53  1  0.396799  0.213592  0.211257  1
  C  C54  1  0.891453  1.094377  0.228174  1
  C  C55  1  0.383635  0.631129  0.277910  1
  C  C56  1  0.494226  0.296639  0.269335  1
  C  C57  1  0.627142  0.554067  0.240752  1
  C  C58  1  0.887363  1.033944  0.270925  1
  C  C59  1  0.967881  0.442609  0.248659  1
  C  C60  1  0.866386  0.712059  0.261324  1
  C  C61  1  0.416851  0.885809  0.243750  1
  C  C62  1  0.199333  0.511364  0.262839  1
  C  C63  1  0.610672  1.005739  0.258165  1
  C  C64  1  0.218556  0.528361  0.314860  1
  C  C65  1  0.454551  0.211818  0.311730  1
  C  C66  1  0.647910  0.628968  0.291518  1
  C  C67  1  0.899892  0.843049  0.311886  1
  C  C68  1  0.736744  0.285531  0.283848  1
  C  C69  1  0.992422  0.551338  0.300048  1
  C  C70  1  0.180025  0.943894  0.281733  1
  C  C71  1  1.065629  0.224508  0.291788  1
  C  C72  1  0.577895  0.902687  0.303198  1
  C  C73  1  0.394567  0.266842  0.352682  1
  C  C74  1  0.581118  0.928364  0.349281  1
  C  C75  1  0.528873  0.456913  0.325276  1
  C  C76  1  0.902054  0.700710  0.355452  1
  C  C77  1  0.791817  0.179322  0.320790  1
  C  C78  1  1.053538  0.381284  0.348339  1
  C  C79  1  0.123021  0.818536  0.327393  1
  C  C80  1  1.007115  0.143463  0.335352  1
  C  C81  1  0.452379  0.761077  0.335105  1
  C  C82  1  1.028328  0.383308  0.395131  1
  C  C83  1  0.435952  1.015507  0.400438  1
  C  C84  1  0.551863  0.295429  0.368279  1
  C  C85  1  0.588072  0.698248  0.392439  1
  C  C86  1  0.703477  0.938516  0.366973  1
  C  C87  1  0.738914  0.391372  0.382830  1
  C  C88  1  1.074776  0.852850  0.369561  1
  C  C89  1  1.063503  0.176769  0.379611  1
  C  C90  1  0.269222  0.865197  0.385488  1
  C  C91  1  0.825844  0.272959  0.435114  1
  C  C92  1  0.249857  0.927033  0.438868  1
  C  C93  1  0.283073  0.329385  0.408882  1
  C  C94  1  0.422622  0.625987  0.430062  1
  C  C95  1  0.727710  1.011525  0.412236  1
  C  C96  1  0.561393  0.307843  0.421601  1
  C  C97  1  0.877579  0.687067  0.404485  1
  C  C98  1  0.981036  0.962091  0.426008  1
  C  C99  1  0.137022  0.642123  0.417849  1
  C  C100  1  0.652991  1.097192  0.488575  1
  C  C101  1  1.038497  0.741614  0.475160  1
  C  C102  1  1.100196  0.235082  0.447778  1
  C  C103  1  0.592672  0.296553  0.474170  1
  C  C104  1  0.496592  0.856765  0.453229  1
  C  C105  1  0.384906  0.205956  0.460160  1
  C  C106  1  0.692354  0.595523  0.443276  1
  C  C107  1  0.837605  0.738767  0.459312  1
  C  C108  1  1.078431  0.445066  0.463647  1
  C  C109  1  0.324160  0.654021  0.524218  1
  C  C110  1  0.575700  0.486184  0.537213  1
  C  C111  1  1.007419  0.971595  0.490694  1
  C  C112  1  1.062377  0.939714  0.523641  1
  C  C113  1  0.211079  0.634865  0.490983  1
  C  C114  1  0.379939  0.972108  0.514839  1
  C  C115  1  0.565253  0.462753  0.490733  1
  C  C116  1  0.427338  0.623770  0.506424  1
  C  C117  1  1.053175  1.100571  0.507953  1
