The compound described by Sr3CoZnO6 crystallizes in the triclinic P-1 space group. There are six inequivalent Sr sites. In the first Sr site, Sr(1) is bonded in a 8-coordinate geometry to one O(1), one O(2), one O(3), one O(5), one O(8), one O(9), and two equivalent O(11) atoms. In the second Sr site, Sr(2) is bonded in a 8-coordinate geometry to one O(1), one O(10), one O(2), one O(4), one O(6), one O(7), and two equivalent O(12) atoms. In the third Sr site, Sr(3) is bonded in a 8-coordinate geometry to one O(1), one O(11), one O(5), one O(7), one O(8), one O(9), and two equivalent O(3) atoms. In the fourth Sr site, Sr(4) is bonded in a 8-coordinate geometry to one O(10), one O(12), one O(2), one O(6), one O(7), one O(8), and two equivalent O(4) atoms. In the fifth Sr site, Sr(5) is bonded in a 8-coordinate geometry to one O(1), one O(10), one O(12), one O(3), one O(5), one O(6), one O(7), and one O(9) atom. In the sixth Sr site, Sr(6) is bonded in a 8-coordinate geometry to one O(10), one O(11), one O(2), one O(4), one O(5), one O(6), one O(8), and one O(9) atom. There are four inequivalent Co sites. In the first Co site, Co(1) is bonded in an octahedral geometry to two equivalent O(2), two equivalent O(4), and two equivalent O(6) atoms. In the second Co site, Co(2) is bonded in an octahedral geometry to two equivalent O(10), two equivalent O(12), and two equivalent O(7) atoms. In the third Co site, Co(3) is bonded in an octahedral geometry to two equivalent O(1), two equivalent O(3), and two equivalent O(5) atoms. In the fourth Co site, Co(4) is bonded in an octahedral geometry to two equivalent O(11), two equivalent O(8), and two equivalent O(9) atoms. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a 6-coordinate geometry to one O(1), one O(10), one O(12), one O(3), one O(5), and one O(7) atom. In the second Zn site, Zn(2) is bonded in a 6-coordinate geometry to one O(11), one O(2), one O(4), one O(6), one O(8), and one O(9) atom. There are twelve inequivalent O sites. In the first O site, O(1) is bonded to one Sr(1), one Sr(2), one Sr(3), one Sr(5), one Co(3), and one Zn(1) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-67°. In the second O site, O(2) is bonded to one Sr(1), one Sr(2), one Sr(4), one Sr(6), one Co(1), and one Zn(2) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-69°. In the third O site, O(3) is bonded to one Sr(1), one Sr(5), two equivalent Sr(3), one Co(3), and one Zn(1) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-63°. In the fourth O site, O(4) is bonded in a 6-coordinate geometry to one Sr(2), one Sr(6), two equivalent Sr(4), one Co(1), and one Zn(2) atom. In the fifth O site, O(5) is bonded to one Sr(1), one Sr(3), one Sr(5), one Sr(6), one Co(3), and one Zn(1) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-67°. In the sixth O site, O(6) is bonded to one Sr(2), one Sr(4), one Sr(5), one Sr(6), one Co(1), and one Zn(2) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-69°. In the seventh O site, O(7) is bonded to one Sr(2), one Sr(3), one Sr(4), one Sr(5), one Co(2), and one Zn(1) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-69°. In the eighth O site, O(8) is bonded to one Sr(1), one Sr(3), one Sr(4), one Sr(6), one Co(4), and one Zn(2) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-67°. In the ninth O site, O(9) is bonded to one Sr(1), one Sr(3), one Sr(5), one Sr(6), one Co(4), and one Zn(2) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-63°. In the tenth O site, O(10) is bonded in a 6-coordinate geometry to one Sr(2), one Sr(4), one Sr(5), one Sr(6), one Co(2), and one Zn(1) atom. In the eleventh O site, O(11) is bonded to one Sr(3), one Sr(6), two equivalent Sr(1), one Co(4), and one Zn(2) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-67°. In the twelfth O site, O(12) is bonded to one Sr(4), one Sr(5), two equivalent Sr(2), one Co(2), and one Zn(1) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-69°. is represented by the CIF card [CIF]
data_Sr3ZnCoO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.578
_cell_length_b   6.582
_cell_length_c   6.966
_cell_angle_alpha   91.668
_cell_angle_beta   91.727
_cell_angle_gamma   94.217
_symmetry_Int_Tables_number   1
_cell_volume   300.477
_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
  Co  Co0  1  0.500  0.500  0.500  1.0
  Co  Co1  1  1.000  1.000  1.000  1.0
  O  O2  1  0.786  0.470  0.581  1.0
  O  O3  1  0.576  0.769  0.437  1.0
  O  O4  1  0.468  0.608  0.788  1.0
  O  O5  1  0.108  0.968  0.289  1.0
  O  O6  1  0.269  0.077  0.938  1.0
  O  O7  1  0.969  0.286  0.081  1.0
  O  O8  1  0.214  0.530  0.419  1.0
  O  O9  1  0.424  0.231  0.563  1.0
  O  O10  1  0.532  0.392  0.212  1.0
  O  O11  1  0.892  0.032  0.711  1.0
  O  O12  1  0.731  0.923  0.062  1.0
  O  O13  1  0.031  0.714  0.919  1.0
  Sr  Sr14  1  0.115  0.385  0.750  1.0
  Sr  Sr15  1  0.753  0.118  0.387  1.0
  Sr  Sr16  1  0.382  0.746  0.113  1.0
  Sr  Sr17  1  0.247  0.882  0.613  1.0
  Sr  Sr18  1  0.618  0.254  0.887  1.0
  Sr  Sr19  1  0.885  0.615  0.250  1.0
  Zn  Zn20  1  0.754  0.746  0.750  1.0
  Zn  Zn21  1  0.246  0.254  0.250  1.0
[/CIF]
.
The compound described by Sr3CoZnO6 crystallizes in the triclinic P-1 space group. There are six inequivalent Sr sites. In the first Sr site, Sr(1) is bonded in a 8-coordinate geometry to one O(1), one O(2), one O(3), one O(5), one O(8), one O(9), and two equivalent O(11) atoms. In the second Sr site, Sr(2) is bonded in a 8-coordinate geometry to one O(1), one O(10), one O(2), one O(4), one O(6), one O(7), and two equivalent O(12) atoms. In the third Sr site, Sr(3) is bonded in a 8-coordinate geometry to one O(1), one O(11), one O(5), one O(7), one O(8), one O(9), and two equivalent O(3) atoms. In the fourth Sr site, Sr(4) is bonded in a 8-coordinate geometry to one O(10), one O(12), one O(2), one O(6), one O(7), one O(8), and two equivalent O(4) atoms. In the fifth Sr site, Sr(5) is bonded in a 8-coordinate geometry to one O(1), one O(10), one O(12), one O(3), one O(5), one O(6), one O(7), and one O(9) atom. In the sixth Sr site, Sr(6) is bonded in a 8-coordinate geometry to one O(10), one O(11), one O(2), one O(4), one O(5), one O(6), one O(8), and one O(9) atom. There are four inequivalent Co sites. In the first Co site, Co(1) is bonded in an octahedral geometry to two equivalent O(2), two equivalent O(4), and two equivalent O(6) atoms. In the second Co site, Co(2) is bonded in an octahedral geometry to two equivalent O(10), two equivalent O(12), and two equivalent O(7) atoms. In the third Co site, Co(3) is bonded in an octahedral geometry to two equivalent O(1), two equivalent O(3), and two equivalent O(5) atoms. In the fourth Co site, Co(4) is bonded in an octahedral geometry to two equivalent O(11), two equivalent O(8), and two equivalent O(9) atoms. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a 6-coordinate geometry to one O(1), one O(10), one O(12), one O(3), one O(5), and one O(7) atom. In the second Zn site, Zn(2) is bonded in a 6-coordinate geometry to one O(11), one O(2), one O(4), one O(6), one O(8), and one O(9) atom. There are twelve inequivalent O sites. In the first O site, O(1) is bonded to one Sr(1), one Sr(2), one Sr(3), one Sr(5), one Co(3), and one Zn(1) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-67°. In the second O site, O(2) is bonded to one Sr(1), one Sr(2), one Sr(4), one Sr(6), one Co(1), and one Zn(2) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-69°. In the third O site, O(3) is bonded to one Sr(1), one Sr(5), two equivalent Sr(3), one Co(3), and one Zn(1) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-63°. In the fourth O site, O(4) is bonded in a 6-coordinate geometry to one Sr(2), one Sr(6), two equivalent Sr(4), one Co(1), and one Zn(2) atom. In the fifth O site, O(5) is bonded to one Sr(1), one Sr(3), one Sr(5), one Sr(6), one Co(3), and one Zn(1) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-67°. In the sixth O site, O(6) is bonded to one Sr(2), one Sr(4), one Sr(5), one Sr(6), one Co(1), and one Zn(2) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-69°. In the seventh O site, O(7) is bonded to one Sr(2), one Sr(3), one Sr(4), one Sr(5), one Co(2), and one Zn(1) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-69°. In the eighth O site, O(8) is bonded to one Sr(1), one Sr(3), one Sr(4), one Sr(6), one Co(4), and one Zn(2) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-67°. In the ninth O site, O(9) is bonded to one Sr(1), one Sr(3), one Sr(5), one Sr(6), one Co(4), and one Zn(2) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-63°. In the tenth O site, O(10) is bonded in a 6-coordinate geometry to one Sr(2), one Sr(4), one Sr(5), one Sr(6), one Co(2), and one Zn(1) atom. In the eleventh O site, O(11) is bonded to one Sr(3), one Sr(6), two equivalent Sr(1), one Co(4), and one Zn(2) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-67°. In the twelfth O site, O(12) is bonded to one Sr(4), one Sr(5), two equivalent Sr(2), one Co(2), and one Zn(1) atom to form a mixture of distorted edge, corner, and face-sharing OSr4ZnCo octahedra. The corner-sharing octahedral tilt angles range from 0-69°. is represented by the CIF card [CIF]
data_Sr3ZnCoO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.578
_cell_length_b   6.582
_cell_length_c   6.966
_cell_angle_alpha   91.668
_cell_angle_beta   91.727
_cell_angle_gamma   94.217
_symmetry_Int_Tables_number   1
_cell_volume   300.477
_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
  Co  Co0  1  0.500  0.500  0.500  1.0
  Co  Co1  1  1.000  1.000  1.000  1.0
  O  O2  1  0.786  0.470  0.581  1.0
  O  O3  1  0.576  0.769  0.437  1.0
  O  O4  1  0.468  0.608  0.788  1.0
  O  O5  1  0.108  0.968  0.289  1.0
  O  O6  1  0.269  0.077  0.938  1.0
  O  O7  1  0.969  0.286  0.081  1.0
  O  O8  1  0.214  0.530  0.419  1.0
  O  O9  1  0.424  0.231  0.563  1.0
  O  O10  1  0.532  0.392  0.212  1.0
  O  O11  1  0.892  0.032  0.711  1.0
  O  O12  1  0.731  0.923  0.062  1.0
  O  O13  1  0.031  0.714  0.919  1.0
  Sr  Sr14  1  0.115  0.385  0.750  1.0
  Sr  Sr15  1  0.753  0.118  0.387  1.0
  Sr  Sr16  1  0.382  0.746  0.113  1.0
  Sr  Sr17  1  0.247  0.882  0.613  1.0
  Sr  Sr18  1  0.618  0.254  0.887  1.0
  Sr  Sr19  1  0.885  0.615  0.250  1.0
  Zn  Zn20  1  0.754  0.746  0.750  1.0
  Zn  Zn21  1  0.246  0.254  0.250  1.0
[/CIF]
.