# generated using pymatgen
data_Fe2Co5N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.68091000
_cell_length_b   25.27336000
_cell_length_c   3.67808000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2Co5N
_chemical_formula_sum   'Fe8 Co20 N4'
_cell_volume   342.16797028
_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  0.07581000  0.00000000  1
  N  N1  1  0.00000000  0.92419000  0.00000000  1
  N  N2  1  0.50000000  0.57581000  0.00000000  1
  N  N3  1  0.50000000  0.42419000  0.00000000  1
  Co  Co4  1  0.00000000  0.71794000  0.00000000  1
  Co  Co5  1  0.00000000  0.28206000  0.00000000  1
  Co  Co6  1  0.50000000  0.21794000  0.00000000  1
  Co  Co7  1  0.50000000  0.78206000  0.00000000  1
  Co  Co8  1  0.00000000  0.78167000  0.50000000  1
  Co  Co9  1  0.00000000  0.21833000  0.50000000  1
  Co  Co10  1  0.50000000  0.28167000  0.50000000  1
  Co  Co11  1  0.50000000  0.71833000  0.50000000  1
  Co  Co12  1  0.00000000  0.42425000  0.00000000  1
  Co  Co13  1  0.00000000  0.57575000  0.00000000  1
  Co  Co14  1  0.50000000  0.92425000  0.00000000  1
  Co  Co15  1  0.50000000  0.07575000  0.00000000  1
  Co  Co16  1  0.00000000  0.14972000  0.00000000  1
  Co  Co17  1  0.00000000  0.85028000  0.00000000  1
  Co  Co18  1  0.50000000  0.64972000  0.00000000  1
  Co  Co19  1  0.50000000  0.35028000  0.00000000  1
  Co  Co20  1  0.00000000  0.92459000  0.50000000  1
  Co  Co21  1  0.00000000  0.07541000  0.50000000  1
  Co  Co22  1  0.50000000  0.42459000  0.50000000  1
  Co  Co23  1  0.50000000  0.57541000  0.50000000  1
  Fe  Fe24  1  0.50000000  0.00000000  0.50000000  1
  Fe  Fe25  1  0.00000000  0.50000000  0.50000000  1
  Fe  Fe26  1  0.00000000  0.65139000  0.50000000  1
  Fe  Fe27  1  0.00000000  0.34861000  0.50000000  1
  Fe  Fe28  1  0.50000000  0.15139000  0.50000000  1
  Fe  Fe29  1  0.50000000  0.84861000  0.50000000  1
  Fe  Fe30  1  0.00000000  0.00000000  0.00000000  1
  Fe  Fe31  1  0.50000000  0.50000000  0.00000000  1
