data_KCd2Si
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.03
_cell_length_b   6.03
_cell_length_c   6.03
_cell_angle_alpha   141.56
_cell_angle_beta   125.62
_cell_angle_gamma   68.55
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KCd2Si
_chemical_formula_sum   'K1 Cd2 Si1'
_cell_volume   109.11
_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  0.0  0.76  0.15  1.0
  Cd  Cd0  1  0.0  0.76  0.73  1.0
  Cd  Cd1  1  0.0  0.0  0.2  1.0
  Si  Si3  1  0.0  0.0  0.87  1.0

data_KCd2Si
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.97
_cell_length_b   5.51
_cell_length_c   6.03
_cell_angle_alpha   117.19
_cell_angle_beta   109.22
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KCd2Si
_chemical_formula_sum   'K1 Cd2 Si1'
_cell_volume   109.11
_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  0.24  0.4  0.4  1.0
  Cd  Cd1  1  0.0  0.2  0.2  1.0
  Cd  Cd2  1  0.24  0.97  0.97  1.0
  Si  Si3  1  0.0  0.87  0.87  1.0

K Cd Cd Si