# generated using pymatgen
data_Fe(CoN)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.31557308
_cell_length_b   6.31522451
_cell_length_c   3.86552900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.96705562
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe(CoN)3
_chemical_formula_sum   'Fe2 Co6 N6'
_cell_volume   133.56270430
_cell_formula_units_Z   2
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  0.66668800  0.33345300  0.75000000  1.0
  Fe  Fe1  1  0.33331200  0.66654700  0.25000000  1.0
  Co  Co2  1  0.82013100  0.63909500  0.25000000  1.0
  Co  Co3  1  0.81884400  0.17967500  0.25000000  1.0
  Co  Co4  1  0.36103000  0.18120300  0.25000000  1.0
  Co  Co5  1  0.17986900  0.36090500  0.75000000  1.0
  Co  Co6  1  0.18115600  0.82032500  0.75000000  1.0
  Co  Co7  1  0.63897000  0.81879700  0.75000000  1.0
  N  N8  1  0.83085200  0.65986700  0.75000000  1.0
  N  N9  1  0.82905100  0.16933500  0.75000000  1.0
  N  N10  1  0.34026500  0.17088700  0.75000000  1.0
  N  N11  1  0.16914800  0.34013300  0.25000000  1.0
  N  N12  1  0.17094900  0.83066500  0.25000000  1.0
  N  N13  1  0.65973500  0.82911300  0.25000000  1.0