data_Co2CuBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.81
_cell_length_b   4.81
_cell_length_c   4.81
_cell_angle_alpha   132.6
_cell_angle_beta   132.6
_cell_angle_gamma   69.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co2CuBi
_chemical_formula_sum   'Co2 Cu1 Bi1'
_cell_volume   59.0
_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
  Co  Co1  1  0.0  0.0  0.0  1.0
  Co  Co2  1  0.93  0.0  0.98  1.0
  Cu  Cu3  1  0.0  0.0  0.95  1.0
  Bi  Bi0  1  0.0  0.93  0.98  1.0

data_Co2CuBi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.86
_cell_length_b   3.86
_cell_length_c   4.81
_cell_angle_alpha   113.7
_cell_angle_beta   113.7
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co2CuBi
_chemical_formula_sum   'Co2 Cu1 Bi1'
_cell_volume   59.0
_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
  Co  Co0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.98  0.05  0.05  1.0
  Cu  Cu2  1  0.95  0.95  0.95  1.0
  Bi  Bi3  1  0.05  0.98  0.05  1.0

Co Co Cu Bi