# generated using pymatgen
data_Co3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.53042000
_cell_length_b   4.53042000
_cell_length_c   13.04734000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co3N
_chemical_formula_sum   'Co18 N6'
_cell_volume   231.91537593
_cell_formula_units_Z   6
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
  N  N0  1  0.00000000  0.00000000  0.00000000  1
  N  N1  1  0.00000000  0.00000000  0.50000000  1
  N  N2  1  0.66666700  0.33333300  0.33333300  1
  N  N3  1  0.66666700  0.33333300  0.83333300  1
  N  N4  1  0.33333300  0.66666700  0.66666700  1
  N  N5  1  0.33333300  0.66666700  0.16666700  1
  Co  Co6  1  0.66894000  0.00000000  0.25000000  1
  Co  Co7  1  0.33106000  0.00000000  0.75000000  1
  Co  Co8  1  0.00000000  0.66894000  0.25000000  1
  Co  Co9  1  0.00000000  0.33106000  0.75000000  1
  Co  Co10  1  0.33106000  0.33106000  0.25000000  1
  Co  Co11  1  0.66894000  0.66894000  0.75000000  1
  Co  Co12  1  0.33560700  0.33333300  0.58333300  1
  Co  Co13  1  0.99772700  0.33333300  0.08333300  1
  Co  Co14  1  0.66666700  0.00227300  0.58333300  1
  Co  Co15  1  0.66666700  0.66439300  0.08333300  1
  Co  Co16  1  0.99772700  0.66439300  0.58333300  1
  Co  Co17  1  0.33560700  0.00227300  0.08333300  1
  Co  Co18  1  0.00227300  0.66666700  0.91666700  1
  Co  Co19  1  0.66439300  0.66666700  0.41666700  1
  Co  Co20  1  0.33333300  0.33560700  0.91666700  1
  Co  Co21  1  0.33333300  0.99772700  0.41666700  1
  Co  Co22  1  0.66439300  0.99772700  0.91666700  1
  Co  Co23  1  0.00227300  0.33560700  0.41666700  1
