data_MgCdSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.57
_cell_length_b   6.57
_cell_length_c   6.57
_cell_angle_alpha   144.22
_cell_angle_beta   140.6
_cell_angle_gamma   54.27
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCdSb2
_chemical_formula_sum   'Mg1 Cd1 Sb2'
_cell_volume   104.62
_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
  Mg  Mg1  1  0.0  0.0  0.96  1.0
  Cd  Cd0  1  0.02  0.0  0.35  1.0
  Sb  Sb2  1  0.02  0.0  0.44  1.0
  Sb  Sb3  1  0.0  0.0  0.8  1.0

data_MgCdSb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.04
_cell_length_b   4.43
_cell_length_c   6.57
_cell_angle_alpha   109.7
_cell_angle_beta   107.89
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCdSb2
_chemical_formula_sum   'Mg1 Cd1 Sb2'
_cell_volume   104.62
_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
  Mg  Mg0  1  0.0  0.96  0.96  1.0
  Cd  Cd1  1  0.0  0.35  0.33  1.0
  Sb  Sb2  1  0.0  0.44  0.42  1.0
  Sb  Sb3  1  0.0  0.8  0.8  1.0

Mg Cd Sb Sb