# generated using pymatgen
data_FeCo2N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.80523000
_cell_length_b   3.67770000
_cell_length_c   11.33952000
_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   158.69084881
_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  0.00000000  0.00000000  1
  N  N1  1  0.00000000  0.50000000  0.50000000  1
  N  N2  1  0.50000000  0.00000000  0.17230000  1
  N  N3  1  0.50000000  0.50000000  0.67230000  1
  Co  Co4  1  0.00000000  0.00000000  0.83496000  1
  Co  Co5  1  0.00000000  0.50000000  0.33496000  1
  Co  Co6  1  0.50000000  0.00000000  0.99071000  1
  Co  Co7  1  0.50000000  0.50000000  0.49071000  1
  Co  Co8  1  0.00000000  0.00000000  0.50116000  1
  Co  Co9  1  0.00000000  0.50000000  0.00116000  1
  Co  Co10  1  0.50000000  0.00000000  0.67596000  1
  Co  Co11  1  0.50000000  0.50000000  0.17596000  1
  Fe  Fe12  1  0.50000000  0.00000000  0.34083000  1
  Fe  Fe13  1  0.50000000  0.50000000  0.84083000  1
  Fe  Fe14  1  0.00000000  0.00000000  0.18361000  1
  Fe  Fe15  1  0.00000000  0.50000000  0.68361000  1
