data_MnCd2Co
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.84
_cell_length_b   4.18
_cell_length_c   5.69
_cell_angle_alpha   90.0
_cell_angle_beta   101.52
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCd2Co
_chemical_formula_sum   'Mn1 Cd2 Co1'
_cell_volume   66.19
_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  0.29  0.0  0.06  1.0
  Cd  Cd0  1  0.6  0.09  0.44  1.0
  Cd  Cd1  1  0.28  0.0  0.55  1.0
  Co  Co2  1  0.67  0.09  0.89  1.0

data_MnCd2Co
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.84
_cell_length_b   4.18
_cell_length_c   5.69
_cell_angle_alpha   90.0
_cell_angle_beta   101.52
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCd2Co
_chemical_formula_sum   'Mn1 Cd2 Co1'
_cell_volume   66.19
_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  0.29  0.0  0.06  1.0
  Cd  Cd1  1  0.28  0.0  0.55  1.0
  Cd  Cd2  1  0.6  0.09  0.44  1.0
  Co  Co3  1  0.67  0.09  0.89  1.0

Mn Cd Cd Co
Mn Cd Cd Co 0 3 - o - 0 3 o o - 1 2 o o o 2 3 o o o 