# generated using pymatgen
data_Fe2Co3N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.70483199
_cell_length_b   6.76711174
_cell_length_c   5.51057038
_cell_angle_alpha   90.00000000
_cell_angle_beta   94.38734379
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2Co3N4
_chemical_formula_sum   'Fe8 Co12 N16'
_cell_volume   323.65759455
_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
  Fe  Fe0  1  0.69362300  0.14102200  0.33816900  1
  Fe  Fe1  1  0.30637700  0.14102200  0.16183100  1
  Fe  Fe2  1  0.30637700  0.85897800  0.66183100  1
  Fe  Fe3  1  0.69362300  0.85897800  0.83816900  1
  Fe  Fe4  1  0.19362300  0.64102200  0.33816900  1
  Fe  Fe5  1  0.80637700  0.64102200  0.16183100  1
  Fe  Fe6  1  0.80637700  0.35897800  0.66183100  1
  Fe  Fe7  1  0.19362300  0.35897800  0.83816900  1
  Co  Co8  1  0.87934400  0.10213600  0.99696600  1
  Co  Co9  1  0.12065600  0.10213600  0.50303400  1
  Co  Co10  1  0.12065600  0.89786400  0.00303400  1
  Co  Co11  1  0.87934400  0.89786400  0.49696600  1
  Co  Co12  1  0.50000000  0.85359100  0.25000000  1
  Co  Co13  1  0.50000000  0.14640900  0.75000000  1
  Co  Co14  1  0.37934400  0.60213600  0.99696600  1
  Co  Co15  1  0.62065600  0.60213600  0.50303400  1
  Co  Co16  1  0.62065600  0.39786400  0.00303400  1
  Co  Co17  1  0.37934400  0.39786400  0.49696600  1
  Co  Co18  1  0.00000000  0.35359100  0.25000000  1
  Co  Co19  1  0.00000000  0.64640900  0.75000000  1
  N  N20  1  0.40266200  0.68053100  0.46463500  1
  N  N21  1  0.59733800  0.68053100  0.03536500  1
  N  N22  1  0.59733800  0.31946900  0.53536500  1
  N  N23  1  0.40266200  0.31946900  0.96463500  1
  N  N24  1  0.65997200  0.09525400  0.01054000  1
  N  N25  1  0.34002800  0.09525400  0.48946000  1
  N  N26  1  0.34002800  0.90474600  0.98946000  1
  N  N27  1  0.65997200  0.90474600  0.51054000  1
  N  N28  1  0.90266200  0.18053100  0.46463500  1
  N  N29  1  0.09733800  0.18053100  0.03536500  1
  N  N30  1  0.09733800  0.81946900  0.53536500  1
  N  N31  1  0.90266200  0.81946900  0.96463500  1
  N  N32  1  0.15997200  0.59525400  0.01054000  1
  N  N33  1  0.84002800  0.59525400  0.48946000  1
  N  N34  1  0.84002800  0.40474600  0.98946000  1
  N  N35  1  0.15997200  0.40474600  0.51054000  1
