data_YTaZnRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.68
_cell_length_b   4.68
_cell_length_c   4.68
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTaZnRh
_chemical_formula_sum   'Y1 Ta1 Zn1 Rh1'
_cell_volume   72.36
_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
  Y  Y2  1  0.31  0.31  0.31  1.0
  Ta  Ta1  1  0.65  0.65  0.65  1.0
  Zn  Zn3  1  0.0  0.0  0.0  1.0
  Rh  Rh0  1  0.96  0.96  0.96  1.0

data_YTaZnRh
_symmetry_space_group_name_H-M   R3m
_cell_length_a   4.68
_cell_length_b   4.68
_cell_length_c   11.46
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   YTaZnRh
_chemical_formula_sum   'Y3 Ta3 Zn3 Rh3'
_cell_volume   217.09
_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
  Y  Y0  3  0.0  0.0  0.69  1.0
  Ta  Ta1  3  0.0  0.0  0.35  1.0
  Zn  Zn2  3  0.0  0.0  0.0  1.0
  Rh  Rh3  3  0.0  0.0  0.04  1.0

Y Ta Zn Rh
Y Ta Zn Rh 0 2 o o + 0 2 o + o 0 2 + o o 0 3 - - o 0 3 - o - 0 3 o - - 0 1 - o o 0 1 o - o 0 1 o o - 1 2 o + + 1 2 + o + 1 2 + + o 1 3 - o o 1 3 o - o 1 3 o o - 2 3 - - - 
YTaRhZn crystallizes in the trigonal R3m space group. Y(1) is bonded in a 11-coordinate geometry to four equivalent Ta(1), three equivalent Rh(1), and four equivalent Zn(1) atoms. There are three shorter (2.70 Å) and one longer (3.97 Å) Y(1)-Ta(1) bond length. All Y(1)-Rh(1) bond lengths are 2.70 Å. There are three shorter (2.72 Å) and one longer (3.52 Å) Y(1)-Zn(1) bond length. Ta(1) is bonded in a 11-coordinate geometry to four equivalent Y(1), four equivalent Rh(1), and three equivalent Zn(1) atoms. There are three shorter (2.72 Å) and one longer (3.52 Å) Ta(1)-Rh(1) bond length. All Ta(1)-Zn(1) bond lengths are 2.70 Å. Rh(1) is bonded in a single-bond geometry to three equivalent Y(1), four equivalent Ta(1), and one Zn(1) atom. The Rh(1)-Zn(1) bond length is 0.44 Å. Zn(1) is bonded in a single-bond geometry to four equivalent Y(1), three equivalent Ta(1), and one Rh(1) atom.