data_KCd2Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.84
_cell_length_b   5.84
_cell_length_c   5.84
_cell_angle_alpha   99.37
_cell_angle_beta   99.37
_cell_angle_gamma   27.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KCd2Mo
_chemical_formula_sum   'K1 Cd2 Mo1'
_cell_volume   92.07
_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
  K  K2  1  0.17  0.0  0.15  1.0
  Cd  Cd0  1  0.95  0.0  0.36  1.0
  Cd  Cd1  1  0.25  0.0  0.19  1.0
  Mo  Mo3  1  0.15  0.0  0.93  1.0

data_KCd2Mo
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.82
_cell_length_b   5.84
_cell_length_c   5.84
_cell_angle_alpha   99.37
_cell_angle_beta   90.0
_cell_angle_gamma   103.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KCd2Mo
_chemical_formula_sum   'K1 Cd2 Mo1'
_cell_volume   92.07
_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
  K  K0  1  0.0  0.83  0.85  1.0
  Cd  Cd1  1  0.0  0.05  0.64  1.0
  Cd  Cd2  1  0.0  0.75  0.81  1.0
  Mo  Mo3  1  0.0  0.85  0.07  1.0

K Cd Cd Mo