The structure described by Ba3InB3O9 crystallizes in the trigonal R-3 space group. Ba(1) is bonded in a 9-coordinate geometry to two equivalent O(1), three equivalent O(3), and four equivalent O(2) atoms. There are two inequivalent In sites. In the first In site, In(1) is bonded in an octahedral geometry to six equivalent O(3) atoms. In the second In site, In(2) is bonded in an octahedral geometry to six equivalent O(1) atoms. B(1) is bonded in a trigonal planar geometry to one O(1), one O(2), and one O(3) atom. There are three inequivalent O sites. In the first O site, O(1) is bonded in a 1-coordinate geometry to two equivalent Ba(1), one In(2), and one B(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to four equivalent Ba(1) and one B(1) atom. In the third O site, O(3) is bonded in a 1-coordinate geometry to three equivalent Ba(1), one In(1), and one B(1) atom. is represented by the CIF file [CIF]
data_Ba3In(BO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.043
_cell_length_b   8.043
_cell_length_c   8.043
_cell_angle_alpha   105.721
_cell_angle_beta   105.721
_cell_angle_gamma   105.721
_symmetry_Int_Tables_number   1
_cell_volume   447.568
_cell_formula_units_Z   2
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
  Ba  Ba0  1  0.156  0.665  0.763  1.0
  Ba  Ba1  1  0.763  0.156  0.665  1.0
  Ba  Ba2  1  0.665  0.763  0.156  1.0
  Ba  Ba3  1  0.844  0.335  0.237  1.0
  Ba  Ba4  1  0.237  0.844  0.335  1.0
  Ba  Ba5  1  0.335  0.237  0.844  1.0
  In  In6  1  0.000  0.000  0.000  1.0
  In  In7  1  0.500  0.500  0.500  1.0
  B  B8  1  0.135  0.209  0.451  1.0
  B  B9  1  0.451  0.135  0.209  1.0
  B  B10  1  0.209  0.451  0.135  1.0
  B  B11  1  0.865  0.791  0.549  1.0
  B  B12  1  0.549  0.865  0.791  1.0
  B  B13  1  0.791  0.549  0.865  1.0
  O  O14  1  0.324  0.238  0.502  1.0
  O  O15  1  0.502  0.324  0.238  1.0
  O  O16  1  0.238  0.502  0.324  1.0
  O  O17  1  0.676  0.762  0.498  1.0
  O  O18  1  0.498  0.676  0.762  1.0
  O  O19  1  0.762  0.498  0.676  1.0
  O  O20  1  0.068  0.301  0.571  1.0
  O  O21  1  0.571  0.068  0.301  1.0
  O  O22  1  0.301  0.571  0.068  1.0
  O  O23  1  0.932  0.699  0.429  1.0
  O  O24  1  0.429  0.932  0.699  1.0
  O  O25  1  0.699  0.429  0.932  1.0
  O  O26  1  0.008  0.070  0.282  1.0
  O  O27  1  0.282  0.008  0.070  1.0
  O  O28  1  0.070  0.282  0.008  1.0
  O  O29  1  0.992  0.930  0.718  1.0
  O  O30  1  0.718  0.992  0.930  1.0
  O  O31  1  0.930  0.718  0.992  1.0
[/CIF]
.
The structure described by Ba3InB3O9 crystallizes in the trigonal R-3 space group. Ba(1) is bonded in a 9-coordinate geometry to two equivalent O(1), three equivalent O(3), and four equivalent O(2) atoms. There are two inequivalent In sites. In the first In site, In(1) is bonded in an octahedral geometry to six equivalent O(3) atoms. In the second In site, In(2) is bonded in an octahedral geometry to six equivalent O(1) atoms. B(1) is bonded in a trigonal planar geometry to one O(1), one O(2), and one O(3) atom. There are three inequivalent O sites. In the first O site, O(1) is bonded in a 1-coordinate geometry to two equivalent Ba(1), one In(2), and one B(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to four equivalent Ba(1) and one B(1) atom. In the third O site, O(3) is bonded in a 1-coordinate geometry to three equivalent Ba(1), one In(1), and one B(1) atom. is represented by the CIF file [CIF]
data_Ba3In(BO3)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.043
_cell_length_b   8.043
_cell_length_c   8.043
_cell_angle_alpha   105.721
_cell_angle_beta   105.721
_cell_angle_gamma   105.721
_symmetry_Int_Tables_number   1
_cell_volume   447.568
_cell_formula_units_Z   2
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
  Ba  Ba0  1  0.156  0.665  0.763  1.0
  Ba  Ba1  1  0.763  0.156  0.665  1.0
  Ba  Ba2  1  0.665  0.763  0.156  1.0
  Ba  Ba3  1  0.844  0.335  0.237  1.0
  Ba  Ba4  1  0.237  0.844  0.335  1.0
  Ba  Ba5  1  0.335  0.237  0.844  1.0
  In  In6  1  0.000  0.000  0.000  1.0
  In  In7  1  0.500  0.500  0.500  1.0
  B  B8  1  0.135  0.209  0.451  1.0
  B  B9  1  0.451  0.135  0.209  1.0
  B  B10  1  0.209  0.451  0.135  1.0
  B  B11  1  0.865  0.791  0.549  1.0
  B  B12  1  0.549  0.865  0.791  1.0
  B  B13  1  0.791  0.549  0.865  1.0
  O  O14  1  0.324  0.238  0.502  1.0
  O  O15  1  0.502  0.324  0.238  1.0
  O  O16  1  0.238  0.502  0.324  1.0
  O  O17  1  0.676  0.762  0.498  1.0
  O  O18  1  0.498  0.676  0.762  1.0
  O  O19  1  0.762  0.498  0.676  1.0
  O  O20  1  0.068  0.301  0.571  1.0
  O  O21  1  0.571  0.068  0.301  1.0
  O  O22  1  0.301  0.571  0.068  1.0
  O  O23  1  0.932  0.699  0.429  1.0
  O  O24  1  0.429  0.932  0.699  1.0
  O  O25  1  0.699  0.429  0.932  1.0
  O  O26  1  0.008  0.070  0.282  1.0
  O  O27  1  0.282  0.008  0.070  1.0
  O  O28  1  0.070  0.282  0.008  1.0
  O  O29  1  0.992  0.930  0.718  1.0
  O  O30  1  0.718  0.992  0.930  1.0
  O  O31  1  0.930  0.718  0.992  1.0
[/CIF]
.