# generated using pymatgen
data_FeCo2N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.51100000
_cell_length_b   8.01706000
_cell_length_c   4.34900000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeCo2N
_chemical_formula_sum   'Fe4 Co8 N4'
_cell_volume   157.28140086
_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
  N  N0  1  0.00000000  0.82841000  0.25000000  1
  N  N1  1  0.00000000  0.17159000  0.75000000  1
  N  N2  1  0.50000000  0.32841000  0.25000000  1
  N  N3  1  0.50000000  0.67159000  0.75000000  1
  Co  Co4  1  0.83138000  0.33716000  0.99440000  1
  Co  Co5  1  0.16862000  0.66284000  0.49440000  1
  Co  Co6  1  0.16862000  0.33716000  0.50560000  1
  Co  Co7  1  0.83138000  0.66284000  0.00560000  1
  Co  Co8  1  0.33138000  0.83716000  0.99440000  1
  Co  Co9  1  0.66862000  0.16284000  0.49440000  1
  Co  Co10  1  0.66862000  0.83716000  0.50560000  1
  Co  Co11  1  0.33138000  0.16284000  0.00560000  1
  Fe  Fe12  1  0.82689000  0.00000000  0.00000000  1
  Fe  Fe13  1  0.17311000  0.00000000  0.50000000  1
  Fe  Fe14  1  0.32689000  0.50000000  0.00000000  1
  Fe  Fe15  1  0.67311000  0.50000000  0.50000000  1
