# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03022711
_cell_length_b   4.18675645
_cell_length_c   80.26925417
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.92096637
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C51
_cell_volume   1647.69309763
_cell_formula_units_Z   51
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  0.311542  0.823928  0.023604  1
  C  C2  1  0.496959  1.101569  0.034842  1
  C  C3  1  0.671834  0.371861  0.045449  1
  C  C4  1  -0.147389  0.644790  0.056388  1
  C  C5  1  0.034117  0.913918  0.067095  1
  C  C6  1  0.213729  0.186902  0.077892  1
  C  C7  1  0.392847  0.457602  0.088724  1
  C  C8  1  0.571618  0.728032  0.099646  1
  C  C9  1  0.752215  0.997773  0.110490  1
  C  C10  1  -0.066844  0.267489  0.121327  1
  C  C11  1  0.114058  0.536795  0.132190  1
  C  C12  1  0.293431  0.810323  0.142885  1
  C  C13  1  0.470767  1.086476  0.153525  1
  C  C14  1  0.649231  0.362336  0.164128  1
  C  C15  1  -0.173779  0.639960  0.174698  1
  C  C16  1  0.002960  0.917277  0.185296  1
  C  C17  1  0.181442  0.192122  0.195959  1
  C  C18  1  0.359238  0.467422  0.206631  1
  C  C19  1  0.538674  0.741047  0.217326  1
  C  C20  1  0.717156  1.015597  0.228010  1
  C  C21  1  -0.104494  0.290926  0.238656  1
  C  C22  1  0.074257  0.566490  0.249272  1
  C  C23  1  0.251402  0.844041  0.259838  1
  C  C24  1  0.429698  1.120405  0.270425  1
  C  C25  1  0.606553  0.398519  0.280978  1
  C  C26  1  0.784075  0.675671  0.291556  1
  C  C27  1  -0.038148  0.952641  0.302138  1
  C  C28  1  0.138690  0.230638  0.312696  1
  C  C29  1  0.316959  0.507085  0.323289  1
  C  C30  1  0.494041  0.785151  0.333835  1
  C  C31  1  0.672775  1.060519  0.344468  1
  C  C32  1  -0.148659  0.335669  0.355120  1
  C  C33  1  0.029745  0.610673  0.365792  1
  C  C34  1  0.209148  0.884137  0.376499  1
  C  C35  1  0.386820  1.160221  0.387145  1
  C  C36  1  0.565553  0.434427  0.397837  1
  C  C37  1  0.742697  0.711247  0.408462  1
  C  C38  1  -0.080537  0.989511  0.419008  1
  C  C39  1  0.098068  0.265037  0.429636  1
  C  C40  1  0.275428  0.541561  0.440258  1
  C  C41  1  0.454735  0.815400  0.450954  1
  C  C42  1  0.635702  1.084641  0.461819  1
  C  C43  1  -0.183232  0.354622  0.472652  1
  C  C44  1  -0.002658  0.624100  0.483514  1
  C  C45  1  0.176115  0.894591  0.494429  1
  C  C46  1  0.355149  1.165215  0.505264  1
  C  C47  1  0.534835  0.438060  0.516059  1
  C  C48  1  0.716219  0.707443  0.526755  1
  C  C49  1  -0.103285  0.980632  0.537687  1
  C  C50  1  0.072017  0.250236  0.548316  1
  C  C51  1  0.257125  0.528317  0.559539  1
