[CIF]
data_CaNiBi4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.44917844
_cell_length_b   6.44917844
_cell_length_c   6.44917844
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaNiBi4
_chemical_formula_sum   'Ca1 Ni1 Bi4'
_cell_volume   189.66979861
_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  3.42280906  3.42280906  5.69770656  1
  Bi  Bi1  1  3.42280906  5.69770656  3.42280906  1
  Bi  Bi2  1  5.69770656  3.42280906  3.42280906  1
  Bi  Bi3  1  5.69770656  5.69770656  5.69770656  1
  Ca  Ca4  1  0.00000000  0.00000000  0.00000000  1
  Ni  Ni5  1  2.28012891  2.28012891  2.28012891  1
[/CIF]
