data_MgCdIn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.63
_cell_length_b   5.63
_cell_length_c   5.5
_cell_angle_alpha   99.91
_cell_angle_beta   99.91
_cell_angle_gamma   34.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCdIn2
_chemical_formula_sum   'Mg1 Cd1 In2'
_cell_volume   96.87
_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  Mg3  1  0.9  0.0  0.71  1.0
  Cd  Cd0  1  0.92  0.0  0.03  1.0
  In  In1  1  0.75  0.0  0.39  1.0
  In  In2  1  0.85  0.0  0.39  1.0

data_MgCdIn2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.33
_cell_length_b   5.5
_cell_length_c   5.63
_cell_angle_alpha   99.91
_cell_angle_beta   107.2
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCdIn2
_chemical_formula_sum   'Mg1 Cd1 In2'
_cell_volume   96.87
_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  0.71  0.9  1.0
  Cd  Cd1  1  0.0  0.03  0.92  1.0
  In  In2  1  0.0  0.39  0.85  1.0
  In  In3  1  0.0  0.39  0.75  1.0

Mg Cd In In