# generated using pymatgen
data_CoCN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.80685507
_cell_length_b   2.80109785
_cell_length_c   3.95639863
_cell_angle_alpha   90.00000606
_cell_angle_beta   110.85851429
_cell_angle_gamma   60.06782448
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoCN
_chemical_formula_sum   'Co1 C1 N1'
_cell_volume   24.57682355
_cell_formula_units_Z   1
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  0.00501100  0.99749500  0.96796500  1.0
  C  C1  1  0.89032200  0.55483900  0.29508300  1.0
  N  N2  1  0.12266800  0.43866600  0.64595200  1.0