data_Fe2CoBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.43
_cell_length_b   4.43
_cell_length_c   4.43
_cell_angle_alpha   121.23
_cell_angle_beta   121.23
_cell_angle_gamma   87.88
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2CoBi
_chemical_formula_sum   'Fe2 Co1 Bi1'
_cell_volume   60.17
_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  Fe2  1  0.0  0.17  0.59  1.0
  Fe  Fe3  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.0  0.0  0.19  1.0
  Bi  Bi0  1  0.17  0.0  0.59  1.0

data_Fe2CoBi
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.34
_cell_length_b   4.34
_cell_length_c   4.43
_cell_angle_alpha   119.38
_cell_angle_beta   119.38
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2CoBi
_chemical_formula_sum   'Fe2 Co1 Bi1'
_cell_volume   60.17
_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  0.0  0.0  0.0  1.0
  Fe  Fe1  1  0.58  0.17  0.58  1.0
  Co  Co2  1  0.81  0.0  0.81  1.0
  Bi  Bi3  1  0.41  0.0  0.58  1.0

Fe Fe Co Bi