The compound described by Rb12Li(OCl)4 is Pb (Zr_0.50 Ti_0.48) O_3-derived structured and crystallizes in the triclinic P1 space group. There are twelve inequivalent Rb sites. In the first Rb site, Rb(1) is bonded in a 4-coordinate geometry to one O(1), one O(2), one Cl(1), and one Cl(2) atom. In the second Rb site, Rb(2) is bonded in a 3-coordinate geometry to one O(2), one O(4), one Cl(3), and one Cl(4) atom. In the third Rb site, Rb(3) is bonded in a 1-coordinate geometry to one O(1), one Cl(1), and one Cl(3) atom. In the fourth Rb site, Rb(4) is bonded in a distorted square pyramidal geometry to one O(1), one Cl(1), one Cl(2), one Cl(3), and one Cl(4) atom. In the fifth Rb site, Rb(5) is bonded in a distorted see-saw-like geometry to one O(2), one O(4), one Cl(2), and one Cl(3) atom. In the sixth Rb site, Rb(6) is bonded in a 4-coordinate geometry to one O(3), one O(4), one Cl(1), and one Cl(2) atom. In the seventh Rb site, Rb(7) is bonded in a 2-coordinate geometry to one O(3) and one O(4) atom. In the eighth Rb site, Rb(8) is bonded in a 4-coordinate geometry to one O(1), one O(3), one Cl(2), and one Cl(3) atom. In the ninth Rb site, Rb(9) is bonded in a 4-coordinate geometry to one O(2), one O(4), one Cl(2), and one Cl(3) atom. In the tenth Rb site, Rb(10) is bonded in a 5-coordinate geometry to one Li(1), one O(1), one O(3), one Cl(1), and one Cl(2) atom. In the eleventh Rb site, Rb(11) is bonded in a distorted bent 150 degrees geometry to one O(2), one O(4), and one Cl(2) atom. In the twelfth Rb site, Rb(12) is bonded in a 4-coordinate geometry to one O(1), one O(2), one Cl(3), and one Cl(4) atom. Li(1) is bonded in a 3-coordinate geometry to one Rb(10), one O(3), one Cl(1), and one Cl(4) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded to one Rb(1), one Rb(10), one Rb(12), one Rb(3), one Rb(4), and one Rb(8) atom to form corner-sharing ORb6 octahedra. The corner-sharing octahedral tilt angles range from 29-34°. In the second O site, O(2) is bonded to one Rb(1), one Rb(11), one Rb(12), one Rb(2), one Rb(5), and one Rb(9) atom to form corner-sharing ORb6 octahedra. The corner-sharing octahedral tilt angles range from 22-34°. In the third O site, O(3) is bonded in a distorted single-bond geometry to one Rb(10), one Rb(6), one Rb(7), one Rb(8), and one Li(1) atom. In the fourth O site, O(4) is bonded to one Rb(11), one Rb(2), one Rb(5), one Rb(6), one Rb(7), and one Rb(9) atom to form corner-sharing ORb6 octahedra. The corner-sharing octahedral tilt angles range from 22-33°. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a 6-coordinate geometry to one Rb(1), one Rb(10), one Rb(3), one Rb(4), one Rb(6), and one Li(1) atom. In the second Cl site, Cl(2) is bonded in a 8-coordinate geometry to one Rb(1), one Rb(10), one Rb(11), one Rb(4), one Rb(5), one Rb(6), one Rb(8), and one Rb(9) atom. In the third Cl site, Cl(3) is bonded in a 7-coordinate geometry to one Rb(12), one Rb(2), one Rb(3), one Rb(4), one Rb(5), one Rb(8), and one Rb(9) atom. In the fourth Cl site, Cl(4) is bonded in a distorted single-bond geometry to one Rb(12), one Rb(2), one Rb(4), and one Li(1) atom. is represented by the CIF file [CIF]
data_Rb12Li(ClO)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.722
_cell_length_b   8.358
_cell_length_c   10.934
_cell_angle_alpha   90.731
_cell_angle_beta   88.517
_cell_angle_gamma   88.538
_symmetry_Int_Tables_number   1
_cell_volume   705.114
_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
  Rb  Rb0  1  0.078  0.428  0.259  1.0
  Rb  Rb1  1  0.210  0.209  0.559  1.0
  Rb  Rb2  1  0.228  0.244  0.948  1.0
  Rb  Rb3  1  0.253  0.711  0.985  1.0
  Rb  Rb4  1  0.288  0.710  0.524  1.0
  Rb  Rb5  1  0.450  0.001  0.243  1.0
  Rb  Rb6  1  0.579  0.987  0.746  1.0
  Rb  Rb7  1  0.682  0.339  0.031  1.0
  Rb  Rb8  1  0.690  0.309  0.484  1.0
  Rb  Rb9  1  0.768  0.728  0.074  1.0
  Rb  Rb10  1  0.790  0.793  0.444  1.0
  Rb  Rb11  1  0.920  0.548  0.747  1.0
  Li  Li12  1  0.847  0.026  0.978  1.0
  Cl  Cl13  1  0.034  0.013  0.154  1.0
  Cl  Cl14  1  0.482  0.570  0.251  1.0
  Cl  Cl15  1  0.482  0.483  0.769  1.0
  Cl  Cl16  1  0.023  0.957  0.797  1.0
  O  O17  1  0.001  0.489  0.003  1.0
  O  O18  1  0.993  0.504  0.500  1.0
  O  O19  1  0.615  0.024  0.998  1.0
  O  O20  1  0.503  0.012  0.495  1.0
[/CIF]
.
The compound described by Rb12Li(OCl)4 is Pb (Zr_0.50 Ti_0.48) O_3-derived structured and crystallizes in the triclinic P1 space group. There are twelve inequivalent Rb sites. In the first Rb site, Rb(1) is bonded in a 4-coordinate geometry to one O(1), one O(2), one Cl(1), and one Cl(2) atom. In the second Rb site, Rb(2) is bonded in a 3-coordinate geometry to one O(2), one O(4), one Cl(3), and one Cl(4) atom. In the third Rb site, Rb(3) is bonded in a 1-coordinate geometry to one O(1), one Cl(1), and one Cl(3) atom. In the fourth Rb site, Rb(4) is bonded in a distorted square pyramidal geometry to one O(1), one Cl(1), one Cl(2), one Cl(3), and one Cl(4) atom. In the fifth Rb site, Rb(5) is bonded in a distorted see-saw-like geometry to one O(2), one O(4), one Cl(2), and one Cl(3) atom. In the sixth Rb site, Rb(6) is bonded in a 4-coordinate geometry to one O(3), one O(4), one Cl(1), and one Cl(2) atom. In the seventh Rb site, Rb(7) is bonded in a 2-coordinate geometry to one O(3) and one O(4) atom. In the eighth Rb site, Rb(8) is bonded in a 4-coordinate geometry to one O(1), one O(3), one Cl(2), and one Cl(3) atom. In the ninth Rb site, Rb(9) is bonded in a 4-coordinate geometry to one O(2), one O(4), one Cl(2), and one Cl(3) atom. In the tenth Rb site, Rb(10) is bonded in a 5-coordinate geometry to one Li(1), one O(1), one O(3), one Cl(1), and one Cl(2) atom. In the eleventh Rb site, Rb(11) is bonded in a distorted bent 150 degrees geometry to one O(2), one O(4), and one Cl(2) atom. In the twelfth Rb site, Rb(12) is bonded in a 4-coordinate geometry to one O(1), one O(2), one Cl(3), and one Cl(4) atom. Li(1) is bonded in a 3-coordinate geometry to one Rb(10), one O(3), one Cl(1), and one Cl(4) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded to one Rb(1), one Rb(10), one Rb(12), one Rb(3), one Rb(4), and one Rb(8) atom to form corner-sharing ORb6 octahedra. The corner-sharing octahedral tilt angles range from 29-34°. In the second O site, O(2) is bonded to one Rb(1), one Rb(11), one Rb(12), one Rb(2), one Rb(5), and one Rb(9) atom to form corner-sharing ORb6 octahedra. The corner-sharing octahedral tilt angles range from 22-34°. In the third O site, O(3) is bonded in a distorted single-bond geometry to one Rb(10), one Rb(6), one Rb(7), one Rb(8), and one Li(1) atom. In the fourth O site, O(4) is bonded to one Rb(11), one Rb(2), one Rb(5), one Rb(6), one Rb(7), and one Rb(9) atom to form corner-sharing ORb6 octahedra. The corner-sharing octahedral tilt angles range from 22-33°. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a 6-coordinate geometry to one Rb(1), one Rb(10), one Rb(3), one Rb(4), one Rb(6), and one Li(1) atom. In the second Cl site, Cl(2) is bonded in a 8-coordinate geometry to one Rb(1), one Rb(10), one Rb(11), one Rb(4), one Rb(5), one Rb(6), one Rb(8), and one Rb(9) atom. In the third Cl site, Cl(3) is bonded in a 7-coordinate geometry to one Rb(12), one Rb(2), one Rb(3), one Rb(4), one Rb(5), one Rb(8), and one Rb(9) atom. In the fourth Cl site, Cl(4) is bonded in a distorted single-bond geometry to one Rb(12), one Rb(2), one Rb(4), and one Li(1) atom. is represented by the CIF file [CIF]
data_Rb12Li(ClO)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.722
_cell_length_b   8.358
_cell_length_c   10.934
_cell_angle_alpha   90.731
_cell_angle_beta   88.517
_cell_angle_gamma   88.538
_symmetry_Int_Tables_number   1
_cell_volume   705.114
_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
  Rb  Rb0  1  0.078  0.428  0.259  1.0
  Rb  Rb1  1  0.210  0.209  0.559  1.0
  Rb  Rb2  1  0.228  0.244  0.948  1.0
  Rb  Rb3  1  0.253  0.711  0.985  1.0
  Rb  Rb4  1  0.288  0.710  0.524  1.0
  Rb  Rb5  1  0.450  0.001  0.243  1.0
  Rb  Rb6  1  0.579  0.987  0.746  1.0
  Rb  Rb7  1  0.682  0.339  0.031  1.0
  Rb  Rb8  1  0.690  0.309  0.484  1.0
  Rb  Rb9  1  0.768  0.728  0.074  1.0
  Rb  Rb10  1  0.790  0.793  0.444  1.0
  Rb  Rb11  1  0.920  0.548  0.747  1.0
  Li  Li12  1  0.847  0.026  0.978  1.0
  Cl  Cl13  1  0.034  0.013  0.154  1.0
  Cl  Cl14  1  0.482  0.570  0.251  1.0
  Cl  Cl15  1  0.482  0.483  0.769  1.0
  Cl  Cl16  1  0.023  0.957  0.797  1.0
  O  O17  1  0.001  0.489  0.003  1.0
  O  O18  1  0.993  0.504  0.500  1.0
  O  O19  1  0.615  0.024  0.998  1.0
  O  O20  1  0.503  0.012  0.495  1.0
[/CIF]
.