data_MgNbCd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.51
_cell_length_b   5.51
_cell_length_c   5.4
_cell_angle_alpha   103.47
_cell_angle_beta   103.47
_cell_angle_gamma   30.65
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgNbCd2
_chemical_formula_sum   'Mg1 Nb1 Cd2'
_cell_volume   81.01
_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  Mg2  1  0.67  0.0  0.62  1.0
  Nb  Nb3  1  0.64  0.0  0.26  1.0
  Cd  Cd0  1  0.57  0.0  0.11  1.0
  Cd  Cd1  1  0.71  0.0  0.88  1.0

data_MgNbCd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.91
_cell_length_b   5.4
_cell_length_c   5.51
_cell_angle_alpha   103.47
_cell_angle_beta   105.33
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgNbCd2
_chemical_formula_sum   'Mg1 Nb1 Cd2'
_cell_volume   81.01
_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  0.62  0.67  1.0
  Nb  Nb1  1  0.0  0.26  0.64  1.0
  Cd  Cd2  1  0.0  0.11  0.57  1.0
  Cd  Cd3  1  0.0  0.88  0.71  1.0

Mg Nb Cd Cd