data_LaCdCo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.54
_cell_length_b   5.54
_cell_length_c   4.69
_cell_angle_alpha   108.96
_cell_angle_beta   108.96
_cell_angle_gamma   33.13
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCdCo2
_chemical_formula_sum   'La1 Cd1 Co2'
_cell_volume   74.09
_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
  La  La3  1  0.49  0.0  0.08  1.0
  Cd  Cd0  1  0.66  0.0  0.56  1.0
  Co  Co1  1  0.73  0.0  0.36  1.0
  Co  Co2  1  0.07  0.0  0.04  1.0

data_LaCdCo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.16
_cell_length_b   4.69
_cell_length_c   5.54
_cell_angle_alpha   108.96
_cell_angle_beta   106.57
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCdCo2
_chemical_formula_sum   'La1 Cd1 Co2'
_cell_volume   74.09
_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
  La  La0  1  0.0  0.08  0.49  1.0
  Cd  Cd1  1  0.0  0.56  0.66  1.0
  Co  Co2  1  0.0  0.04  0.07  1.0
  Co  Co3  1  0.0  0.36  0.73  1.0

La Cd Co Co
La Cd Co Co 0 2 o o o 0 3 o o o 1 2 o o o 1 3 + o + 2 3 + o o 