data_CdNiAgW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.5
_cell_length_b   4.5
_cell_length_c   4.5
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdNiAgW
_chemical_formula_sum   'Cd1 Ni1 Ag1 W1'
_cell_volume   64.61
_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
  Cd  Cd1  1  0.59  0.59  0.59  1.0
  Ni  Ni2  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.78  0.78  0.78  1.0
  W  W3  1  0.18  0.18  0.18  1.0

data_CdNiAgW
_symmetry_space_group_name_H-M   R3m
_cell_length_a   4.5
_cell_length_b   4.5
_cell_length_c   11.03
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   CdNiAgW
_chemical_formula_sum   'Cd3 Ni3 Ag3 W3'
_cell_volume   193.84
_cell_formula_units_Z   3
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
  10  '-y+1/3, -x+2/3, z+2/3'
  11  '-x+y+1/3, y+2/3, z+2/3'
  12  'x+1/3, x-y+2/3, z+2/3'
  13  'x+2/3, y+1/3, z+1/3'
  14  '-y+2/3, x-y+1/3, z+1/3'
  15  '-x+y+2/3, -x+1/3, z+1/3'
  16  '-y+2/3, -x+1/3, z+1/3'
  17  '-x+y+2/3, y+1/3, z+1/3'
  18  'x+2/3, x-y+1/3, z+1/3'
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
  Cd  Cd0  3  0.0  0.0  0.41  1.0
  Ni  Ni1  3  0.0  0.0  1.0  1.0
  Ag  Ag2  3  0.0  0.0  0.22  1.0
  W  W3  3  0.0  0.0  0.82  1.0

Cd Ni Ag W
Cd Ni Ag W 0 3 o o + 0 3 o + o 0 3 + o o 0 1 o + + 0 1 + o + 0 1 + + o 0 2 o o o 1 2 - - - 1 3 o o o 2 3 + + o 2 3 + o + 2 3 o + + 
WNiAgCd crystallizes in the trigonal R3m space group. W(1) is bonded in a 1-coordinate geometry to one Ni(1) and three equivalent Cd(1) atoms. The W(1)-Ni(1) bond length is 2.04 Å. All W(1)-Cd(1) bond lengths are 2.73 Å. Ni(1) is bonded in a distorted single-bond geometry to one W(1) and three equivalent Cd(1) atoms. All Ni(1)-Cd(1) bond lengths are 2.73 Å. Ag(1) is bonded in a distorted single-bond geometry to four equivalent Cd(1) atoms. There is one shorter (2.04 Å) and three longer (3.07 Å) Ag(1)-Cd(1) bond lengths. Cd(1) is bonded in a 10-coordinate geometry to three equivalent W(1), three equivalent Ni(1), and four equivalent Ag(1) atoms.