data_MnCrCd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.49
_cell_length_b   9.49
_cell_length_c   9.49
_cell_angle_alpha   16.92
_cell_angle_beta   16.92
_cell_angle_gamma   16.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCrCd2
_chemical_formula_sum   'Mn1 Cr1 Cd2'
_cell_volume   63.25
_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  0.03  1.0
  Cr  Cr2  1  0.0  0.0  0.0  1.0
  Cd  Cd0  1  0.0  0.0  0.09  1.0
  Cd  Cd1  1  0.0  0.0  0.98  1.0

data_MnCrCd2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.84
_cell_length_b   2.79
_cell_length_c   9.49
_cell_angle_alpha   90.0
_cell_angle_beta   99.78
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   MnCrCd2
_chemical_formula_sum   'Mn2 Cr2 Cd4'
_cell_volume   126.5
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.97  1.0
  Cr  Cr1  2  0.0  0.0  0.0  1.0
  Cd  Cd2  2  0.0  0.0  0.02  1.0
  Cd  Cd3  2  0.0  0.0  0.91  1.0

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