The structure described by MnZn2SbO6 crystallizes in the monoclinic P2_1/m space group. Mn(1) is bonded to two equivalent O(2), two equivalent O(3), and two equivalent O(4) atoms to form MnO6 octahedra that share corners with two equivalent Mn(1)O6 octahedra, corners with four equivalent Sb(1)O6 octahedra, and corners with four equivalent Zn(2)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 39-46°. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a distorted rectangular see-saw-like geometry to one O(1), one O(2), and two equivalent O(3) atoms. In the second Zn site, Zn(2) is bonded to one O(1), one O(2), and two equivalent O(4) atoms to form distorted ZnO4 tetrahedra that share corners with four equivalent Mn(1)O6 octahedra and corners with four equivalent Sb(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 66-80°. Sb(1) is bonded to two equivalent O(1), two equivalent O(3), and two equivalent O(4) atoms to form SbO6 octahedra that share corners with two equivalent Sb(1)O6 octahedra, corners with four equivalent Mn(1)O6 octahedra, and corners with four equivalent Zn(2)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 44-49°. There are four inequivalent O sites. In the first O site, O(1) is bonded to one Zn(1), one Zn(2), and two equivalent Sb(1) atoms to form OZn2Sb2 tetrahedra that share corners with two equivalent O(1)Zn2Sb2 tetrahedra and corners with two equivalent O(2)Mn2Zn2 trigonal pyramids. In the second O site, O(2) is bonded to two equivalent Mn(1), one Zn(1), and one Zn(2) atom to form distorted OMn2Zn2 trigonal pyramids that share corners with two equivalent O(1)Zn2Sb2 tetrahedra and corners with two equivalent O(2)Mn2Zn2 trigonal pyramids. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Mn(1), one Zn(1), and one Sb(1) atom. In the fourth O site, O(4) is bonded in a 3-coordinate geometry to one Mn(1), one Zn(2), and one Sb(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_MnZn2SbO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.321
_cell_length_b   5.368
_cell_length_c   7.668
_cell_angle_alpha   90.000
_cell_angle_beta   89.999
_cell_angle_gamma   93.864
_symmetry_Int_Tables_number   1
_cell_volume   218.504
_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
  Mn  Mn0  1  0.000  0.500  0.500  1.0
  Mn  Mn1  1  1.000  0.500  1.000  1.0
  O  O2  1  0.589  0.871  0.750  1.0
  O  O3  1  0.411  0.129  0.250  1.0
  O  O4  1  0.918  0.399  0.250  1.0
  O  O5  1  0.082  0.601  0.750  1.0
  O  O6  1  0.677  0.330  0.563  1.0
  O  O7  1  0.323  0.670  0.063  1.0
  O  O8  1  0.677  0.330  0.937  1.0
  O  O9  1  0.323  0.670  0.437  1.0
  O  O10  1  0.192  0.156  0.929  1.0
  O  O11  1  0.808  0.844  0.429  1.0
  O  O12  1  0.192  0.156  0.571  1.0
  O  O13  1  0.808  0.844  0.071  1.0
  Sb  Sb14  1  0.500  0.000  0.500  1.0
  Sb  Sb15  1  0.500  1.000  0.000  1.0
  Zn  Zn16  1  0.553  0.521  0.250  1.0
  Zn  Zn17  1  0.447  0.479  0.750  1.0
  Zn  Zn18  1  0.014  0.041  0.250  1.0
  Zn  Zn19  1  0.986  0.959  0.750  1.0
[/CIF]
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The structure described by MnZn2SbO6 crystallizes in the monoclinic P2_1/m space group. Mn(1) is bonded to two equivalent O(2), two equivalent O(3), and two equivalent O(4) atoms to form MnO6 octahedra that share corners with two equivalent Mn(1)O6 octahedra, corners with four equivalent Sb(1)O6 octahedra, and corners with four equivalent Zn(2)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 39-46°. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a distorted rectangular see-saw-like geometry to one O(1), one O(2), and two equivalent O(3) atoms. In the second Zn site, Zn(2) is bonded to one O(1), one O(2), and two equivalent O(4) atoms to form distorted ZnO4 tetrahedra that share corners with four equivalent Mn(1)O6 octahedra and corners with four equivalent Sb(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 66-80°. Sb(1) is bonded to two equivalent O(1), two equivalent O(3), and two equivalent O(4) atoms to form SbO6 octahedra that share corners with two equivalent Sb(1)O6 octahedra, corners with four equivalent Mn(1)O6 octahedra, and corners with four equivalent Zn(2)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 44-49°. There are four inequivalent O sites. In the first O site, O(1) is bonded to one Zn(1), one Zn(2), and two equivalent Sb(1) atoms to form OZn2Sb2 tetrahedra that share corners with two equivalent O(1)Zn2Sb2 tetrahedra and corners with two equivalent O(2)Mn2Zn2 trigonal pyramids. In the second O site, O(2) is bonded to two equivalent Mn(1), one Zn(1), and one Zn(2) atom to form distorted OMn2Zn2 trigonal pyramids that share corners with two equivalent O(1)Zn2Sb2 tetrahedra and corners with two equivalent O(2)Mn2Zn2 trigonal pyramids. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Mn(1), one Zn(1), and one Sb(1) atom. In the fourth O site, O(4) is bonded in a 3-coordinate geometry to one Mn(1), one Zn(2), and one Sb(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_MnZn2SbO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.321
_cell_length_b   5.368
_cell_length_c   7.668
_cell_angle_alpha   90.000
_cell_angle_beta   89.999
_cell_angle_gamma   93.864
_symmetry_Int_Tables_number   1
_cell_volume   218.504
_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
  Mn  Mn0  1  0.000  0.500  0.500  1.0
  Mn  Mn1  1  1.000  0.500  1.000  1.0
  O  O2  1  0.589  0.871  0.750  1.0
  O  O3  1  0.411  0.129  0.250  1.0
  O  O4  1  0.918  0.399  0.250  1.0
  O  O5  1  0.082  0.601  0.750  1.0
  O  O6  1  0.677  0.330  0.563  1.0
  O  O7  1  0.323  0.670  0.063  1.0
  O  O8  1  0.677  0.330  0.937  1.0
  O  O9  1  0.323  0.670  0.437  1.0
  O  O10  1  0.192  0.156  0.929  1.0
  O  O11  1  0.808  0.844  0.429  1.0
  O  O12  1  0.192  0.156  0.571  1.0
  O  O13  1  0.808  0.844  0.071  1.0
  Sb  Sb14  1  0.500  0.000  0.500  1.0
  Sb  Sb15  1  0.500  1.000  0.000  1.0
  Zn  Zn16  1  0.553  0.521  0.250  1.0
  Zn  Zn17  1  0.447  0.479  0.750  1.0
  Zn  Zn18  1  0.014  0.041  0.250  1.0
  Zn  Zn19  1  0.986  0.959  0.750  1.0
[/CIF]
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