data_ScTaRe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.81
_cell_length_b   2.81
_cell_length_c   9.03
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScTaRe2
_chemical_formula_sum   'Sc1 Ta1 Re2'
_cell_volume   67.1
_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
  Sc  Sc2  1  0.0  0.0  0.0  1.0
  Ta  Ta3  1  0.0  0.0  0.51  1.0
  Re  Re0  1  0.61  0.0  0.71  1.0
  Re  Re1  1  0.61  0.0  0.32  1.0

data_ScTaRe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.81
_cell_length_b   2.81
_cell_length_c   9.03
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScTaRe2
_chemical_formula_sum   'Sc1 Ta1 Re2'
_cell_volume   67.1
_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
  Sc  Sc0  1  0.0  0.0  0.0  1.0
  Ta  Ta1  1  0.0  0.0  0.51  1.0
  Re  Re2  1  0.61  0.0  0.32  1.0
  Re  Re3  1  0.61  0.0  0.71  1.0

Sc Ta Re Re
ScTaRe2 crystallizes in the triclinic P1 space group. Sc(1) is bonded in a 8-coordinate geometry to four equivalent Sc(1), two equivalent Re(1), and two equivalent Re(2) atoms. All Sc(1)-Sc(1) bond lengths are 2.81 Å. There is one shorter (2.85 Å) and one longer (3.15 Å) Sc(1)-Re(1) bond length. There is one shorter (3.07 Å) and one longer (3.35 Å) Sc(1)-Re(2) bond length. Ta(1) is bonded in a 4-coordinate geometry to two equivalent Re(1) and two equivalent Re(2) atoms. There is one shorter (2.07 Å) and one longer (2.47 Å) Ta(1)-Re(1) bond length. There is one shorter (2.07 Å) and one longer (2.47 Å) Ta(1)-Re(2) bond length. There are two inequivalent Re sites. In the first Re site, Re(1) is bonded in a 1-coordinate geometry to two equivalent Sc(1) and two equivalent Ta(1) atoms. In the second Re site, Re(2) is bonded in a 1-coordinate geometry to two equivalent Sc(1) and two equivalent Ta(1) atoms.