# generated using pymatgen
data_Fe3CoN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.78900000
_cell_length_b   3.74500000
_cell_length_c   7.54800000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3CoN
_chemical_formula_sum   'Fe6 Co2 N2'
_cell_volume   107.10464814
_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
  N  N0  1  0.00000000  0.00000000  0.00180000  1
  N  N1  1  0.00000000  0.00000000  0.49881000  1
  Co  Co2  1  0.00000000  0.00000000  0.25210000  1
  Co  Co3  1  0.00000000  0.50000000  0.49496000  1
  Fe  Fe4  1  0.50000000  0.50000000  0.25203000  1
  Fe  Fe5  1  0.50000000  0.00000000  0.00511000  1
  Fe  Fe6  1  0.00000000  0.00000000  0.74833000  1
  Fe  Fe7  1  0.50000000  0.00000000  0.49497000  1
  Fe  Fe8  1  0.00000000  0.50000000  0.00581000  1
  Fe  Fe9  1  0.50000000  0.50000000  0.74607000  1
