# generated using pymatgen
data_FeCo6N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.68608000
_cell_length_b   3.69128000
_cell_length_c   24.87657000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeCo6N
_chemical_formula_sum   'Fe4 Co24 N4'
_cell_volume   338.47940236
_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  0.00000000  0.00000000  0.84723000  1
  N  N3  1  0.00000000  0.50000000  0.34723000  1
  Co  Co4  1  0.00000000  0.00000000  0.20784000  1
  Co  Co5  1  0.00000000  0.50000000  0.70784000  1
  Co  Co6  1  0.50000000  0.00000000  0.27144000  1
  Co  Co7  1  0.50000000  0.50000000  0.77144000  1
  Co  Co8  1  0.50000000  0.00000000  0.14179000  1
  Co  Co9  1  0.50000000  0.50000000  0.64179000  1
  Co  Co10  1  0.00000000  0.00000000  0.49721000  1
  Co  Co11  1  0.00000000  0.50000000  0.99721000  1
  Co  Co12  1  0.00000000  0.00000000  0.34920000  1
  Co  Co13  1  0.00000000  0.50000000  0.84920000  1
  Co  Co14  1  0.50000000  0.00000000  0.70752000  1
  Co  Co15  1  0.50000000  0.50000000  0.20752000  1
  Co  Co16  1  0.00000000  0.00000000  0.77260000  1
  Co  Co17  1  0.00000000  0.50000000  0.27260000  1
  Co  Co18  1  0.50000000  0.00000000  0.99703000  1
  Co  Co19  1  0.50000000  0.50000000  0.49703000  1
  Co  Co20  1  0.00000000  0.00000000  0.92334000  1
  Co  Co21  1  0.00000000  0.50000000  0.42334000  1
  Co  Co22  1  0.00000000  0.00000000  0.64187000  1
  Co  Co23  1  0.00000000  0.50000000  0.14187000  1
  Co  Co24  1  0.00000000  0.00000000  0.07397000  1
  Co  Co25  1  0.00000000  0.50000000  0.57397000  1
  Co  Co26  1  0.50000000  0.00000000  0.84929000  1
  Co  Co27  1  0.50000000  0.50000000  0.34929000  1
  Fe  Fe28  1  0.50000000  0.00000000  0.42328000  1
  Fe  Fe29  1  0.50000000  0.50000000  0.92328000  1
  Fe  Fe30  1  0.50000000  0.00000000  0.57614000  1
  Fe  Fe31  1  0.50000000  0.50000000  0.07614000  1
