data_MnCdSn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.57
_cell_length_b   5.85
_cell_length_c   5.85
_cell_angle_alpha   35.17
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCdSn2
_chemical_formula_sum   'Mn1 Cd1 Sn2'
_cell_volume   90.27
_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  Mn1  1  0.0  0.0  0.7  1.0
  Cd  Cd0  1  0.29  0.0  0.91  1.0
  Sn  Sn2  1  0.29  0.0  0.0  1.0
  Sn  Sn3  1  0.0  0.0  0.59  1.0

data_MnCdSn2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.54
_cell_length_b   4.57
_cell_length_c   5.85
_cell_angle_alpha   90.0
_cell_angle_beta   107.58
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCdSn2
_chemical_formula_sum   'Mn1 Cd1 Sn2'
_cell_volume   90.27
_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  0.3  0.0  0.3  1.0
  Cd  Cd1  1  0.09  0.29  0.09  1.0
  Sn  Sn2  1  0.41  0.0  0.41  1.0
  Sn  Sn3  1  1.0  0.29  1.0  1.0

Mn Cd Sn Sn
Mn Cd Sn Sn 0 3 o o o 1 2 o o + 