The compound described by Ba4La2RuSbO12 crystallizes in the triclinic P-1 space group. There are two inequivalent Ba sites. In the first Ba site, Ba(1) is bonded in a 12-coordinate geometry to one O(1), one O(4), one O(5), three equivalent O(2), three equivalent O(3), and three equivalent O(6) atoms. In the second Ba site, Ba(2) is bonded in a 12-coordinate geometry to one O(2), one O(3), one O(6), three equivalent O(1), three equivalent O(4), and three equivalent O(5) atoms. La(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form LaO6 octahedra that share corners with three equivalent Ru(1)O6 octahedra and corners with three equivalent Sb(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 10-15°. Ru(1) is bonded to two equivalent O(1), two equivalent O(4), and two equivalent O(5) atoms to form RuO6 octahedra that share corners with six equivalent La(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 10-13°. Sb(1) is bonded to two equivalent O(2), two equivalent O(3), and two equivalent O(6) atoms to form SbO6 octahedra that share corners with six equivalent La(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 11-15°. There are six inequivalent O sites. In the first O site, O(1) is bonded in a 6-coordinate geometry to one Ba(1), three equivalent Ba(2), one La(1), and one Ru(1) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Ba(2), three equivalent Ba(1), one La(1), and one Sb(1) atom. In the third O site, O(3) is bonded in a 2-coordinate geometry to one Ba(2), three equivalent Ba(1), one La(1), and one Sb(1) atom. In the fourth O site, O(4) is bonded in a 6-coordinate geometry to one Ba(1), three equivalent Ba(2), one La(1), and one Ru(1) atom. In the fifth O site, O(5) is bonded in a 2-coordinate geometry to one Ba(1), three equivalent Ba(2), one La(1), and one Ru(1) atom. In the sixth O site, O(6) is bonded in a 2-coordinate geometry to one Ba(2), three equivalent Ba(1), one La(1), and one Sb(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Ba4La2SbRuO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.114
_cell_length_b   6.137
_cell_length_c   10.617
_cell_angle_alpha   90.417
_cell_angle_beta   106.484
_cell_angle_gamma   119.490
_symmetry_Int_Tables_number   1
_cell_volume   327.318
_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
  Ba  Ba0  1  0.246  0.128  0.871  1.0
  Ba  Ba1  1  0.251  0.630  0.379  1.0
  Ba  Ba2  1  0.749  0.370  0.621  1.0
  Ba  Ba3  1  0.754  0.872  0.129  1.0
  La  La4  1  0.500  0.750  0.749  1.0
  La  La5  1  0.500  0.250  0.251  1.0
  Sb  Sb6  1  0.000  0.500  0.000  1.0
  Ru  Ru7  1  0.000  0.000  0.500  1.0
  O  O8  1  0.812  0.905  0.633  1.0
  O  O9  1  0.815  0.406  0.138  1.0
  O  O10  1  0.185  0.594  0.862  1.0
  O  O11  1  0.188  0.095  0.367  1.0
  O  O12  1  0.769  0.137  0.902  1.0
  O  O13  1  0.772  0.642  0.402  1.0
  O  O14  1  0.228  0.358  0.598  1.0
  O  O15  1  0.231  0.863  0.098  1.0
  O  O16  1  0.267  0.921  0.609  1.0
  O  O17  1  0.272  0.422  0.111  1.0
  O  O18  1  0.728  0.578  0.889  1.0
  O  O19  1  0.733  0.079  0.391  1.0
[/CIF]
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The compound described by Ba4La2RuSbO12 crystallizes in the triclinic P-1 space group. There are two inequivalent Ba sites. In the first Ba site, Ba(1) is bonded in a 12-coordinate geometry to one O(1), one O(4), one O(5), three equivalent O(2), three equivalent O(3), and three equivalent O(6) atoms. In the second Ba site, Ba(2) is bonded in a 12-coordinate geometry to one O(2), one O(3), one O(6), three equivalent O(1), three equivalent O(4), and three equivalent O(5) atoms. La(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form LaO6 octahedra that share corners with three equivalent Ru(1)O6 octahedra and corners with three equivalent Sb(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 10-15°. Ru(1) is bonded to two equivalent O(1), two equivalent O(4), and two equivalent O(5) atoms to form RuO6 octahedra that share corners with six equivalent La(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 10-13°. Sb(1) is bonded to two equivalent O(2), two equivalent O(3), and two equivalent O(6) atoms to form SbO6 octahedra that share corners with six equivalent La(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 11-15°. There are six inequivalent O sites. In the first O site, O(1) is bonded in a 6-coordinate geometry to one Ba(1), three equivalent Ba(2), one La(1), and one Ru(1) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Ba(2), three equivalent Ba(1), one La(1), and one Sb(1) atom. In the third O site, O(3) is bonded in a 2-coordinate geometry to one Ba(2), three equivalent Ba(1), one La(1), and one Sb(1) atom. In the fourth O site, O(4) is bonded in a 6-coordinate geometry to one Ba(1), three equivalent Ba(2), one La(1), and one Ru(1) atom. In the fifth O site, O(5) is bonded in a 2-coordinate geometry to one Ba(1), three equivalent Ba(2), one La(1), and one Ru(1) atom. In the sixth O site, O(6) is bonded in a 2-coordinate geometry to one Ba(2), three equivalent Ba(1), one La(1), and one Sb(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Ba4La2SbRuO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.114
_cell_length_b   6.137
_cell_length_c   10.617
_cell_angle_alpha   90.417
_cell_angle_beta   106.484
_cell_angle_gamma   119.490
_symmetry_Int_Tables_number   1
_cell_volume   327.318
_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
  Ba  Ba0  1  0.246  0.128  0.871  1.0
  Ba  Ba1  1  0.251  0.630  0.379  1.0
  Ba  Ba2  1  0.749  0.370  0.621  1.0
  Ba  Ba3  1  0.754  0.872  0.129  1.0
  La  La4  1  0.500  0.750  0.749  1.0
  La  La5  1  0.500  0.250  0.251  1.0
  Sb  Sb6  1  0.000  0.500  0.000  1.0
  Ru  Ru7  1  0.000  0.000  0.500  1.0
  O  O8  1  0.812  0.905  0.633  1.0
  O  O9  1  0.815  0.406  0.138  1.0
  O  O10  1  0.185  0.594  0.862  1.0
  O  O11  1  0.188  0.095  0.367  1.0
  O  O12  1  0.769  0.137  0.902  1.0
  O  O13  1  0.772  0.642  0.402  1.0
  O  O14  1  0.228  0.358  0.598  1.0
  O  O15  1  0.231  0.863  0.098  1.0
  O  O16  1  0.267  0.921  0.609  1.0
  O  O17  1  0.272  0.422  0.111  1.0
  O  O18  1  0.728  0.578  0.889  1.0
  O  O19  1  0.733  0.079  0.391  1.0
[/CIF]
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