data_CoGeBi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.81
_cell_length_b   4.21
_cell_length_c   4.95
_cell_angle_alpha   90.0
_cell_angle_beta   112.52
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoGeBi2
_chemical_formula_sum   'Co1 Ge1 Bi2'
_cell_volume   92.69
_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  Co2  1  0.8  0.0  0.07  1.0
  Ge  Ge3  1  0.63  0.11  0.43  1.0
  Bi  Bi0  1  0.45  0.0  0.28  1.0
  Bi  Bi1  1  0.3  0.11  0.08  1.0

data_CoGeBi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.21
_cell_length_b   4.81
_cell_length_c   4.95
_cell_angle_alpha   112.52
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoGeBi2
_chemical_formula_sum   'Co1 Ge1 Bi2'
_cell_volume   92.69
_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  0.2  0.93  1.0
  Ge  Ge1  1  0.89  0.37  0.57  1.0
  Bi  Bi2  1  0.0  0.55  0.72  1.0
  Bi  Bi3  1  0.89  0.7  0.92  1.0

Co Ge Bi Bi
Co Ge Bi Bi 0 3 o o o 0 3 + o o 0 2 o o o 0 1 o o o 1 2 o o o 2 3 o o o 