data_Fe3Co5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.69
_cell_length_b   4.69
_cell_length_c   4.91
_cell_angle_alpha   99.99
_cell_angle_beta   99.99
_cell_angle_gamma   117.02
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3Co5
_chemical_formula_sum   'Fe3 Co5'
_cell_volume   90.81
_cell_formula_units_Z   1
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
  Fe  Fe5  1  0.26  1.0  0.16  1.0
  Fe  Fe6  1  0.02  1.0  0.47  1.0
  Fe  Fe7  1  0.45  0.99  0.0  1.0
  Co  Co0  1  0.64  0.05  0.31  1.0
  Co  Co1  1  0.01  0.01  0.48  1.0
  Co  Co2  1  0.45  0.98  0.0  1.0
  Co  Co3  1  0.64  0.96  0.31  1.0
  Co  Co4  1  0.27  0.01  0.15  1.0

data_Fe3Co5
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.69
_cell_length_b   4.69
_cell_length_c   4.91
_cell_angle_alpha   99.99
_cell_angle_beta   99.99
_cell_angle_gamma   117.02
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3Co5
_chemical_formula_sum   'Fe3 Co5'
_cell_volume   90.81
_cell_formula_units_Z   1
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
  Fe  Fe0  1  0.02  1.0  0.47  1.0
  Fe  Fe1  1  0.26  1.0  0.16  1.0
  Fe  Fe2  1  0.45  0.99  -0.0  1.0
  Co  Co3  1  0.01  0.01  0.48  1.0
  Co  Co4  1  0.27  0.01  0.15  1.0
  Co  Co5  1  0.45  0.98  -0.0  1.0
  Co  Co6  1  0.64  0.05  0.31  1.0
  Co  Co7  1  0.64  0.96  0.31  1.0

Fe Fe Fe Co Co Co Co Co
Fe Fe Fe Co Co Co Co Co 0 7 o + o 1 4 o + o 2 5 o o o 3 6 o - o 