# generated using pymatgen
data_Fe3Co4N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.78394000
_cell_length_b   3.78354000
_cell_length_c   24.05654000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3Co4N
_chemical_formula_sum   'Fe12 Co16 N4'
_cell_volume   344.40998590
_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  0.84553000  1
  N  N3  1  0.00000000  0.50000000  0.34553000  1
  Co  Co4  1  0.00000000  0.00000000  0.64291000  1
  Co  Co5  1  0.00000000  0.50000000  0.14291000  1
  Co  Co6  1  0.00000000  0.00000000  0.49883000  1
  Co  Co7  1  0.00000000  0.50000000  0.99883000  1
  Co  Co8  1  0.50000000  0.00000000  0.14266000  1
  Co  Co9  1  0.50000000  0.50000000  0.64266000  1
  Co  Co10  1  0.00000000  0.00000000  0.07590000  1
  Co  Co11  1  0.00000000  0.50000000  0.57590000  1
  Co  Co12  1  0.50000000  0.00000000  0.27045000  1
  Co  Co13  1  0.50000000  0.50000000  0.77045000  1
  Co  Co14  1  0.00000000  0.00000000  0.92349000  1
  Co  Co15  1  0.00000000  0.50000000  0.42349000  1
  Co  Co16  1  0.00000000  0.00000000  0.76806000  1
  Co  Co17  1  0.00000000  0.50000000  0.26806000  1
  Co  Co18  1  0.50000000  0.00000000  0.99883000  1
  Co  Co19  1  0.50000000  0.50000000  0.49883000  1
  Fe  Fe20  1  0.50000000  0.00000000  0.42150000  1
  Fe  Fe21  1  0.50000000  0.50000000  0.92150000  1
  Fe  Fe22  1  0.50000000  0.00000000  0.57664000  1
  Fe  Fe23  1  0.50000000  0.50000000  0.07664000  1
  Fe  Fe24  1  0.50000000  0.00000000  0.70627000  1
  Fe  Fe25  1  0.50000000  0.50000000  0.20627000  1
  Fe  Fe26  1  0.00000000  0.00000000  0.34533000  1
  Fe  Fe27  1  0.00000000  0.50000000  0.84533000  1
  Fe  Fe28  1  0.50000000  0.00000000  0.84537000  1
  Fe  Fe29  1  0.50000000  0.50000000  0.34537000  1
  Fe  Fe30  1  0.00000000  0.00000000  0.20619000  1
  Fe  Fe31  1  0.00000000  0.50000000  0.70619000  1
