# generated using pymatgen
data_Fe4Co3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.85119000
_cell_length_b   3.85070000
_cell_length_c   23.30496000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe4Co3N
_chemical_formula_sum   'Fe16 Co12 N4'
_cell_volume   345.60736755
_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  0.65137000  1
  N  N3  1  0.50000000  0.50000000  0.15137000  1
  Co  Co4  1  0.50000000  0.00000000  0.73111000  1
  Co  Co5  1  0.50000000  0.50000000  0.23111000  1
  Co  Co6  1  0.00000000  0.00000000  0.92056000  1
  Co  Co7  1  0.00000000  0.50000000  0.42056000  1
  Co  Co8  1  0.00000000  0.00000000  0.07981000  1
  Co  Co9  1  0.00000000  0.50000000  0.57981000  1
  Co  Co10  1  0.00000000  0.00000000  0.35594000  1
  Co  Co11  1  0.00000000  0.50000000  0.85594000  1
  Co  Co12  1  0.50000000  0.00000000  0.85603000  1
  Co  Co13  1  0.50000000  0.50000000  0.35603000  1
  Co  Co14  1  0.00000000  0.00000000  0.22876000  1
  Co  Co15  1  0.00000000  0.50000000  0.72876000  1
  Fe  Fe16  1  0.50000000  0.00000000  0.99948000  1
  Fe  Fe17  1  0.50000000  0.50000000  0.49948000  1
  Fe  Fe18  1  0.00000000  0.00000000  0.65332000  1
  Fe  Fe19  1  0.00000000  0.50000000  0.15332000  1
  Fe  Fe20  1  0.00000000  0.00000000  0.49948000  1
  Fe  Fe21  1  0.00000000  0.50000000  0.99948000  1
  Fe  Fe22  1  0.50000000  0.00000000  0.29258000  1
  Fe  Fe23  1  0.50000000  0.50000000  0.79258000  1
  Fe  Fe24  1  0.50000000  0.00000000  0.56945000  1
  Fe  Fe25  1  0.50000000  0.50000000  0.06945000  1
  Fe  Fe26  1  0.50000000  0.00000000  0.15311000  1
  Fe  Fe27  1  0.50000000  0.50000000  0.65311000  1
  Fe  Fe28  1  0.00000000  0.00000000  0.79280000  1
  Fe  Fe29  1  0.00000000  0.50000000  0.29280000  1
  Fe  Fe30  1  0.50000000  0.00000000  0.42297000  1
  Fe  Fe31  1  0.50000000  0.50000000  0.92297000  1
