data_ZrVIn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.64
_cell_length_b   3.64
_cell_length_c   6.29
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrVIn2
_chemical_formula_sum   'Zr1 V1 In2'
_cell_volume   83.43
_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  0.82  0.82  0.52  1.0
  V  V2  1  0.0  0.0  0.3  1.0
  In  In0  1  0.0  0.0  0.25  1.0
  In  In1  1  0.82  0.82  0.65  1.0

data_ZrVIn2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.15
_cell_length_b   5.15
_cell_length_c   6.29
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ZrVIn2
_chemical_formula_sum   'Zr2 V2 In4'
_cell_volume   166.86
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.32  0.5  0.52  1.0
  V  V1  2  0.0  0.0  0.3  1.0
  In  In2  2  0.0  0.0  0.25  1.0
  In  In3  2  0.32  0.5  0.65  1.0

Zr V In In
ZrVIn2 crystallizes in the monoclinic Cm space group. The structure is zero-dimensional and consists of two ZrVIn2 clusters. Zr(1) is bonded in a distorted bent 150 degrees geometry to one V(1) and one In(2) atom. The Zr(1)-V(1) bond length is 1.65 Å. The Zr(1)-In(2) bond length is 0.82 Å. V(1) is bonded in a distorted bent 150 degrees geometry to one Zr(1) and one In(1) atom. The V(1)-In(1) bond length is 0.33 Å. There are two inequivalent In sites. In the first In site, In(1) is bonded in a single-bond geometry to one V(1) atom. In the second In site, In(2) is bonded in a single-bond geometry to one Zr(1) atom.