[CIF]
data_CaCuBi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.49581954
_cell_length_b   3.49581954
_cell_length_c   8.90443511
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   91.62587642
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaCuBi2
_chemical_formula_sum   'Ca1 Cu1 Bi2'
_cell_volume   108.77510280
_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
  Bi  Bi0  1  0.00000000  0.00000000  0.64813353  1
  Bi  Bi1  1  2.43659739  0.00000000  6.45990152  1
  Ca  Ca2  1  0.00000000  0.00000000  4.07778054  1
  Cu  Cu3  1  2.43659739  0.00000000  2.17083699  1
[/CIF]
