data_VCr2In
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.74
_cell_length_b   2.74
_cell_length_c   8.35
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   112.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCr2In
_chemical_formula_sum   'V1 Cr2 In1'
_cell_volume   58.06
_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
  V  V3  1  0.0  0.0  0.0  1.0
  Cr  Cr0  1  0.53  0.0  0.86  1.0
  Cr  Cr1  1  0.53  0.0  0.49  1.0
  In  In2  1  0.0  0.0  0.17  1.0

data_VCr2In
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.74
_cell_length_b   2.74
_cell_length_c   8.35
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   112.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VCr2In
_chemical_formula_sum   'V1 Cr2 In1'
_cell_volume   58.06
_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
  V  V0  1  0.0  0.0  0.0  1.0
  Cr  Cr1  1  0.53  0.0  0.49  1.0
  Cr  Cr2  1  0.53  0.0  0.86  1.0
  In  In3  1  0.0  0.0  0.17  1.0

V Cr Cr In
V Cr Cr In 0 1 - o - 0 1 o o - 0 3 o o o 1 2 o o o 2 2 + + o 2 2 o + o 2 2 + o o 2 3 o o o 2 3 + o o 
VCr2In crystallizes in the triclinic P1 space group. V(1) is bonded in a 3-coordinate geometry to two equivalent Cr(1) and one In(1) atom. There is one shorter (1.74 Å) and one longer (1.86 Å) V(1)-Cr(1) bond length. The V(1)-In(1) bond length is 1.45 Å. There are two inequivalent Cr sites. In the first Cr site, Cr(1) is bonded in a water-like geometry to two equivalent V(1) and one Cr(2) atom. The Cr(1)-Cr(2) bond length is 3.12 Å. In the second Cr site, Cr(2) is bonded in a 9-coordinate geometry to one Cr(1), six equivalent Cr(2), and two equivalent In(1) atoms. There are four shorter (2.74 Å) and two longer (3.06 Å) Cr(2)-Cr(2) bond lengths. There is one shorter (2.91 Å) and one longer (2.99 Å) Cr(2)-In(1) bond length. In(1) is bonded in a single-bond geometry to one V(1) and two equivalent Cr(2) atoms.