# generated using pymatgen
data_CrCo2N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.82929453
_cell_length_b   5.09585423
_cell_length_c   5.15729337
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrCo2N3
_chemical_formula_sum   'Cr4 Co8 N12'
_cell_volume   232.04105820
_cell_formula_units_Z   4
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
  Cr  Cr0  1  0.83721900  0.50000000  0.44068100  1
  Cr  Cr1  1  0.16278100  0.50000000  0.94068100  1
  Cr  Cr2  1  0.33721900  0.00000000  0.44068100  1
  Cr  Cr3  1  0.66278100  0.00000000  0.94068100  1
  Co  Co4  1  0.17473700  0.15636300  0.99395800  1
  Co  Co5  1  0.67473700  0.34363700  0.99395800  1
  Co  Co6  1  0.32526300  0.34363700  0.49395800  1
  Co  Co7  1  0.82526300  0.15636300  0.49395800  1
  Co  Co8  1  0.67473700  0.65636300  0.99395800  1
  Co  Co9  1  0.17473700  0.84363700  0.99395800  1
  Co  Co10  1  0.82526300  0.84363700  0.49395800  1
  Co  Co11  1  0.32526300  0.65636300  0.49395800  1
  N  N12  1  0.16316600  0.17231800  0.35682300  1
  N  N13  1  0.66316600  0.32768200  0.35682300  1
  N  N14  1  0.33683400  0.32768200  0.85682300  1
  N  N15  1  0.83683400  0.17231800  0.85682300  1
  N  N16  1  0.82923100  0.50000000  0.80210400  1
  N  N17  1  0.67076900  0.00000000  0.30210400  1
  N  N18  1  0.66316600  0.67231800  0.35682300  1
  N  N19  1  0.16316600  0.82768200  0.35682300  1
  N  N20  1  0.83683400  0.82768200  0.85682300  1
  N  N21  1  0.33683400  0.67231800  0.85682300  1
  N  N22  1  0.32923100  0.00000000  0.80210400  1
  N  N23  1  0.17076900  0.50000000  0.30210400  1
