data_Zn4CoRe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.86
_cell_length_b   4.86
_cell_length_c   4.86
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zn4CoRe
_chemical_formula_sum   'Zn4 Co1 Re1'
_cell_volume   81.36
_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
  Zn  Zn2  1  0.58  0.58  0.3  1.0
  Zn  Zn3  1  0.58  0.3  0.58  1.0
  Zn  Zn4  1  0.3  0.58  0.58  1.0
  Zn  Zn5  1  0.3  0.3  0.3  1.0
  Co  Co0  1  0.0  0.0  0.0  1.0
  Re  Re1  1  0.72  0.72  0.72  1.0

data_Zn4CoRe
_symmetry_space_group_name_H-M   R3m
_cell_length_a   4.86
_cell_length_b   4.86
_cell_length_c   11.91
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   Zn4CoRe
_chemical_formula_sum   'Zn12 Co3 Re3'
_cell_volume   244.09
_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
  Zn  Zn0  9  0.19  0.09  0.51  1.0
  Zn  Zn1  3  0.0  0.0  0.7  1.0
  Co  Co2  3  0.0  0.0  0.0  1.0
  Re  Re3  3  0.0  0.0  0.28  1.0

Zn Zn Zn Zn Co Re
Zn Zn Zn Zn Co Re 0 1 o o o 0 2 o o o 0 3 + o o 0 3 o + o 0 3 o o o 0 4 + + o 0 4 + o o 0 4 o + o 0 5 o o o 0 5 o o - 1 2 o o o 1 3 + o o 1 3 o o + 1 3 o o o 1 4 + o + 1 4 + o o 1 4 o o + 1 5 o o o 1 5 o - o 2 3 o + o 2 3 o o + 2 3 o o o 2 4 o + + 2 4 o + o 2 4 o o + 2 5 o o o 2 5 - o o 3 4 o o + 3 4 o + o 3 4 + o o 3 5 - o o 3 5 o - o 3 5 o o - 4 5 - - - 4 5 - - o 4 5 - o - 4 5 o - - 
ReCoZn4 crystallizes in the trigonal R3m space group. Re(1) is bonded in a 3-coordinate geometry to three equivalent Co(1), three equivalent Zn(1), and three equivalent Zn(2) atoms. All Re(1)-Co(1) bond lengths are 2.88 Å. All Re(1)-Zn(1) bond lengths are 2.34 Å. All Re(1)-Zn(2) bond lengths are 3.00 Å. Co(1) is bonded in a 15-coordinate geometry to three equivalent Re(1), three equivalent Zn(2), and nine equivalent Zn(1) atoms. All Co(1)-Zn(2) bond lengths are 2.84 Å. There are three shorter (2.95 Å) and six longer (3.10 Å) Co(1)-Zn(1) bond lengths. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a 3-coordinate geometry to one Re(1), three equivalent Co(1), two equivalent Zn(1), and three equivalent Zn(2) atoms. Both Zn(1)-Zn(1) bond lengths are 1.37 Å. There is one shorter (2.38 Å) and two longer (3.05 Å) Zn(1)-Zn(2) bond lengths. In the second Zn site, Zn(2) is bonded in a 15-coordinate geometry to three equivalent Re(1), three equivalent Co(1), and nine equivalent Zn(1) atoms.