data_CaPdW2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.04
_cell_length_b   5.04
_cell_length_c   2.8
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaPdW2
_chemical_formula_sum   'Ca1 Pd1 W2'
_cell_volume   71.31
_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
  Ca  Ca0  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.52  0.52  0.0  1.0
  W  W2  1  0.52  0.0  0.4  1.0
  W  W3  1  0.0  0.52  0.4  1.0

data_CaPdW2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   7.13
_cell_length_b   7.13
_cell_length_c   2.8
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   CaPdW2
_chemical_formula_sum   'Ca2 Pd2 W4'
_cell_volume   142.61
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Ca  Ca0  2  0.0  0.0  0.0  1.0
  Pd  Pd1  2  0.02  0.5  0.0  1.0
  W  W2  4  0.26  0.26  0.4  1.0

Ca Pd W W
Ca Pd W W 0 2 - o - 0 2 - o o 0 2 o o - 0 2 o o o 0 3 o - - 0 3 o - o 0 3 o o - 0 3 o o o 0 0 o o + 1 3 o o - 1 3 o o o 1 3 + o - 1 3 + o o 1 2 o o - 1 2 o o o 1 2 o + - 1 2 o + o 1 1 o o + 2 2 o o + 3 3 o o + 
CaW2Pd crystallizes in the monoclinic Cm space group. Ca(1) is bonded in a 8-coordinate geometry to eight equivalent W(1) atoms. There are a spread of Ca(1)-W(1) bond distances ranging from 2.66-3.12 Å. W(1) is bonded in a 10-coordinate geometry to four equivalent Ca(1), two equivalent W(1), and four equivalent Pd(1) atoms. Both W(1)-W(1) bond lengths are 2.80 Å. There are a spread of W(1)-Pd(1) bond distances ranging from 2.66-3.12 Å. Pd(1) is bonded in a 10-coordinate geometry to eight equivalent W(1) and two equivalent Pd(1) atoms. Both Pd(1)-Pd(1) bond lengths are 2.80 Å.