data_MnCdCu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.72
_cell_length_b   3.78
_cell_length_c   5.75
_cell_angle_alpha   90.0
_cell_angle_beta   97.72
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCdCu2
_chemical_formula_sum   'Mn1 Cd1 Cu2'
_cell_volume   58.58
_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  0.0  1.0
  Cd  Cd0  1  0.61  0.0  0.85  1.0
  Cu  Cu1  1  0.88  0.89  0.51  1.0
  Cu  Cu2  1  0.06  0.89  0.2  1.0

data_MnCdCu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.72
_cell_length_b   3.78
_cell_length_c   5.75
_cell_angle_alpha   90.0
_cell_angle_beta   97.72
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCdCu2
_chemical_formula_sum   'Mn1 Cd1 Cu2'
_cell_volume   58.58
_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  0.0  0.0  1.0
  Cd  Cd1  1  0.61  0.0  0.85  1.0
  Cu  Cu2  1  0.06  0.89  0.2  1.0
  Cu  Cu3  1  0.88  0.89  0.51  1.0

Mn Cd Cu Cu
Mn Cd Cu Cu 0 1 - o - 0 3 o - o 1 2 o - o 2 3 + o o 