The material described by WCrZn2O6 crystallizes in the triclinic P1 space group. W(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 WO6 octahedra that share corners with six equivalent Cr(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-41°. Cr(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 CrO6 octahedra that share corners with six equivalent W(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-41°. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a trigonal planar geometry to one O(1), one O(2), and one O(3) atom. In the second Zn site, Zn(2) is bonded in a 6-coordinate geometry to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to one W(1), one Cr(1), one Zn(1), and one Zn(2) atom. In the second O site, O(2) is bonded in a distorted trigonal pyramidal geometry to one W(1), one Cr(1), one Zn(1), and one Zn(2) atom. In the third O site, O(3) is bonded in a 4-coordinate geometry to one W(1), one Cr(1), one Zn(1), and one Zn(2) atom. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one W(1), one Cr(1), and one Zn(2) atom. In the fifth O site, O(5) is bonded in a distorted trigonal planar geometry to one W(1), one Cr(1), and one Zn(2) atom. In the sixth O site, O(6) is bonded in a distorted trigonal planar geometry to one W(1), one Cr(1), and one Zn(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Zn2CrWO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.226
_cell_length_b   5.232
_cell_length_c   5.537
_cell_angle_alpha   117.925
_cell_angle_beta   90.263
_cell_angle_gamma   119.727
_symmetry_Int_Tables_number   1
_cell_volume   110.496
_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
  Cr  Cr0  1  0.486  0.988  0.506  1.0
  O  O1  1  0.360  0.126  0.261  1.0
  O  O2  1  0.110  0.485  0.270  1.0
  O  O3  1  0.749  0.866  0.265  1.0
  O  O4  1  0.611  0.854  0.754  1.0
  O  O5  1  0.234  0.120  0.753  1.0
  O  O6  1  0.863  0.488  0.750  1.0
  W  W7  1  0.984  0.983  0.998  1.0
  Zn  Zn8  1  0.747  0.503  0.280  1.0
  Zn  Zn9  1  0.205  0.432  0.669  1.0
[/CIF]
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The material described by WCrZn2O6 crystallizes in the triclinic P1 space group. W(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 WO6 octahedra that share corners with six equivalent Cr(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-41°. Cr(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 CrO6 octahedra that share corners with six equivalent W(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-41°. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a trigonal planar geometry to one O(1), one O(2), and one O(3) atom. In the second Zn site, Zn(2) is bonded in a 6-coordinate geometry to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to one W(1), one Cr(1), one Zn(1), and one Zn(2) atom. In the second O site, O(2) is bonded in a distorted trigonal pyramidal geometry to one W(1), one Cr(1), one Zn(1), and one Zn(2) atom. In the third O site, O(3) is bonded in a 4-coordinate geometry to one W(1), one Cr(1), one Zn(1), and one Zn(2) atom. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one W(1), one Cr(1), and one Zn(2) atom. In the fifth O site, O(5) is bonded in a distorted trigonal planar geometry to one W(1), one Cr(1), and one Zn(2) atom. In the sixth O site, O(6) is bonded in a distorted trigonal planar geometry to one W(1), one Cr(1), and one Zn(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Zn2CrWO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.226
_cell_length_b   5.232
_cell_length_c   5.537
_cell_angle_alpha   117.925
_cell_angle_beta   90.263
_cell_angle_gamma   119.727
_symmetry_Int_Tables_number   1
_cell_volume   110.496
_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
  Cr  Cr0  1  0.486  0.988  0.506  1.0
  O  O1  1  0.360  0.126  0.261  1.0
  O  O2  1  0.110  0.485  0.270  1.0
  O  O3  1  0.749  0.866  0.265  1.0
  O  O4  1  0.611  0.854  0.754  1.0
  O  O5  1  0.234  0.120  0.753  1.0
  O  O6  1  0.863  0.488  0.750  1.0
  W  W7  1  0.984  0.983  0.998  1.0
  Zn  Zn8  1  0.747  0.503  0.280  1.0
  Zn  Zn9  1  0.205  0.432  0.669  1.0
[/CIF]
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