# generated using pymatgen
data_CoC2N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.08577827
_cell_length_b   3.08577827
_cell_length_c   21.95403204
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoC2N3
_chemical_formula_sum   'Co3 C6 N9'
_cell_volume   181.03992383
_cell_formula_units_Z   3
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
  Co  Co0  1  0.00000000  0.34823900  0.66666700  1
  Co  Co1  1  0.34823900  0.00000000  0.33333300  1
  Co  Co2  1  0.65176100  0.65176100  0.00000000  1
  C  C3  1  0.00938200  0.33094400  0.22308300  1
  C  C4  1  0.32156200  0.99061800  0.88974900  1
  C  C5  1  0.66905600  0.67843800  0.55641600  1
  C  C6  1  0.99061800  0.32156200  0.11025100  1
  C  C7  1  0.33094400  0.00938200  0.77691700  1
  C  C8  1  0.67843800  0.66905600  0.44358400  1
  N  N9  1  0.00000000  0.31396800  0.16666700  1
  N  N10  1  0.31396800  0.00000000  0.83333300  1
  N  N11  1  0.68603200  0.68603200  0.50000000  1
  N  N12  1  0.01571200  0.33387600  0.27865900  1
  N  N13  1  0.31816500  0.98428800  0.94532600  1
  N  N14  1  0.66612400  0.68183500  0.61199300  1
  N  N15  1  0.98428800  0.31816500  0.05467400  1
  N  N16  1  0.33387600  0.01571200  0.72134100  1
  N  N17  1  0.68183500  0.66612400  0.38800700  1
