data_MnCdCu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.09
_cell_length_b   5.09
_cell_length_c   5.09
_cell_angle_alpha   143.91
_cell_angle_beta   129.38
_cell_angle_gamma   63.73
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCdCu2
_chemical_formula_sum   'Mn1 Cd1 Cu2'
_cell_volume   59.17
_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
  Mn  Mn3  1  0.0  0.0  0.44  1.0
  Cd  Cd0  1  0.58  0.0  0.1  1.0
  Cu  Cu1  1  0.0  0.0  0.51  1.0
  Cu  Cu2  1  0.0  0.17  0.23  1.0

data_MnCdCu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.15
_cell_length_b   4.35
_cell_length_c   5.09
_cell_angle_alpha   115.31
_cell_angle_beta   108.04
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCdCu2
_chemical_formula_sum   'Mn1 Cd1 Cu2'
_cell_volume   59.17
_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
  Mn  Mn0  1  0.0  0.44  0.44  1.0
  Cd  Cd1  1  0.0  0.1  0.52  1.0
  Cu  Cu2  1  0.0  0.51  0.51  1.0
  Cu  Cu3  1  0.83  0.06  0.06  1.0

Mn Cd Cu Cu