data_ZrAgBi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.51
_cell_length_b   5.51
_cell_length_c   5.89
_cell_angle_alpha   98.25
_cell_angle_beta   98.25
_cell_angle_gamma   34.95
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrAgBi2
_chemical_formula_sum   'Zr1 Ag1 Bi2'
_cell_volume   101.25
_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
  Zr  Zr3  1  0.0  0.0  0.0  1.0
  Ag  Ag0  1  0.81  0.0  0.91  1.0
  Bi  Bi1  1  0.58  0.0  0.39  1.0
  Bi  Bi2  1  0.05  0.0  0.43  1.0

data_ZrAgBi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.31
_cell_length_b   5.51
_cell_length_c   5.89
_cell_angle_alpha   98.25
_cell_angle_beta   90.0
_cell_angle_gamma   107.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrAgBi2
_chemical_formula_sum   'Zr1 Ag1 Bi2'
_cell_volume   101.25
_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
  Zr  Zr0  1  0.0  0.0  0.0  1.0
  Ag  Ag1  1  0.0  0.19  0.09  1.0
  Bi  Bi2  1  0.0  0.42  0.61  1.0
  Bi  Bi3  1  0.0  0.95  0.57  1.0

Zr Ag Bi Bi
ZrAgBi2 crystallizes in the triclinic P1 space group. Zr(1) is bonded in a distorted single-bond geometry to one Ag(1), one Bi(1), and one Bi(2) atom. The Zr(1)-Ag(1) bond length is 1.09 Å. The Zr(1)-Bi(1) bond length is 3.65 Å. The Zr(1)-Bi(2) bond length is 2.53 Å. Ag(1) is bonded in a single-bond geometry to one Zr(1) and two equivalent Bi(1) atoms. There is one shorter (3.16 Å) and one longer (3.27 Å) Ag(1)-Bi(1) bond length. There are two inequivalent Bi sites. In the first Bi site, Bi(1) is bonded in a 7-coordinate geometry to one Zr(1), two equivalent Ag(1), two equivalent Bi(1), and two equivalent Bi(2) atoms. Both Bi(1)-Bi(1) bond lengths are 3.31 Å. There is one shorter (2.57 Å) and one longer (2.96 Å) Bi(1)-Bi(2) bond length. In the second Bi site, Bi(2) is bonded in a distorted single-bond geometry to one Zr(1) and two equivalent Bi(1) atoms.