data_TlInPbW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.2
_cell_length_b   5.2
_cell_length_c   5.2
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlInPbW
_chemical_formula_sum   'Tl1 In1 Pb1 W1'
_cell_volume   99.48
_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
  Tl  Tl2  1  0.52  0.52  0.52  1.0
  In  In0  1  0.0  0.0  0.0  1.0
  Pb  Pb1  1  0.68  0.68  0.68  1.0
  W  W3  1  0.84  0.84  0.84  1.0

data_TlInPbW
_symmetry_space_group_name_H-M   R3m
_cell_length_a   5.2
_cell_length_b   5.2
_cell_length_c   12.74
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   TlInPbW
_chemical_formula_sum   'Tl3 In3 Pb3 W3'
_cell_volume   298.44
_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
  Tl  Tl0  3  0.0  0.0  0.48  1.0
  In  In1  3  0.0  0.0  1.0  1.0
  Pb  Pb2  3  0.0  0.0  0.32  1.0
  W  W3  3  0.0  0.0  0.16  1.0

Tl In Pb W
Tl In Pb W 0 2 o o o 1 3 - - - 2 3 o o o 
WTlInPb crystallizes in the trigonal R3m space group. W(1) is bonded to three equivalent Tl(1), one In(1), and one Pb(1) atom to form distorted WTl3InPb trigonal bipyramids that share corners with six equivalent W(1)Tl3InPb trigonal bipyramids,  a cornercorner with one Tl(1)PbW3 trigonal pyramid, corners with three equivalent In(1)Pb3W trigonal pyramids, and edges with three equivalent Pb(1)TlIn3W trigonal bipyramids. All W(1)-Tl(1) bond lengths are 3.01 Å. The W(1)-In(1) bond length is 2.05 Å. The W(1)-Pb(1) bond length is 2.05 Å. Tl(1) is bonded to three equivalent W(1) and one Pb(1) atom to form distorted TlPbW3 trigonal pyramids that share  a cornercorner with one W(1)Tl3InPb trigonal bipyramid, corners with three equivalent Pb(1)TlIn3W trigonal bipyramids, corners with six equivalent Tl(1)PbW3 trigonal pyramids, and edges with three equivalent In(1)Pb3W trigonal pyramids. The Tl(1)-Pb(1) bond length is 2.05 Å. In(1) is bonded to one W(1) and three equivalent Pb(1) atoms to form distorted InPb3W trigonal pyramids that share  a cornercorner with one Pb(1)TlIn3W trigonal bipyramid, corners with three equivalent W(1)Tl3InPb trigonal bipyramids, corners with six equivalent In(1)Pb3W trigonal pyramids, and edges with three equivalent Tl(1)PbW3 trigonal pyramids. All In(1)-Pb(1) bond lengths are 3.01 Å. Pb(1) is bonded to one W(1), one Tl(1), and three equivalent In(1) atoms to form distorted PbTlIn3W trigonal bipyramids that share corners with six equivalent Pb(1)TlIn3W trigonal bipyramids,  a cornercorner with one In(1)Pb3W trigonal pyramid, corners with three equivalent Tl(1)PbW3 trigonal pyramids, and edges with three equivalent W(1)Tl3InPb trigonal bipyramids.