# generated using pymatgen
data_Fe4CoN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.77500000
_cell_length_b   18.03644000
_cell_length_c   3.75800000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe4CoN
_chemical_formula_sum   'Fe16 Co4 N4'
_cell_volume   255.87305424
_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  0.85338000  0.25000000  1
  N  N1  1  0.00000000  0.14662000  0.75000000  1
  N  N2  1  0.50000000  0.35338000  0.25000000  1
  N  N3  1  0.50000000  0.64662000  0.75000000  1
  Co  Co4  1  0.00000000  0.95652000  0.25000000  1
  Co  Co5  1  0.00000000  0.04348000  0.75000000  1
  Co  Co6  1  0.50000000  0.45652000  0.25000000  1
  Co  Co7  1  0.50000000  0.54348000  0.75000000  1
  Fe  Fe8  1  0.00000000  0.14561000  0.25000000  1
  Fe  Fe9  1  0.00000000  0.85439000  0.75000000  1
  Fe  Fe10  1  0.50000000  0.64561000  0.25000000  1
  Fe  Fe11  1  0.50000000  0.35439000  0.75000000  1
  Fe  Fe12  1  0.00000000  0.35499000  0.25000000  1
  Fe  Fe13  1  0.00000000  0.64501000  0.75000000  1
  Fe  Fe14  1  0.50000000  0.85499000  0.25000000  1
  Fe  Fe15  1  0.50000000  0.14501000  0.75000000  1
  Fe  Fe16  1  0.00000000  0.54756000  0.25000000  1
  Fe  Fe17  1  0.00000000  0.45244000  0.75000000  1
  Fe  Fe18  1  0.50000000  0.04756000  0.25000000  1
  Fe  Fe19  1  0.50000000  0.95244000  0.75000000  1
  Fe  Fe20  1  0.00000000  0.74556000  0.25000000  1
  Fe  Fe21  1  0.00000000  0.25444000  0.75000000  1
  Fe  Fe22  1  0.50000000  0.24556000  0.25000000  1
  Fe  Fe23  1  0.50000000  0.75444000  0.75000000  1
