The structure described by MnZrO3 is Ilmenite-like structured and crystallizes in the trigonal R3c space group. Zr(1) is bonded to six equivalent O(1) atoms to form corner-sharing ZrO6 octahedra. The corner-sharing octahedral tilt angles are 42°. Mn(1) is bonded in a 6-coordinate geometry to six equivalent O(1) atoms. O(1) is bonded in a distorted see-saw-like geometry to two equivalent Zr(1) and two equivalent Mn(1) atoms. is represented by the CIF card [CIF]
data_ZrMnO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.472
_cell_length_b   5.812
_cell_length_c   5.472
_cell_angle_alpha   118.076
_cell_angle_beta   119.998
_cell_angle_gamma   61.920
_symmetry_Int_Tables_number   1
_cell_volume   126.521
_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
  Zr  Zr0  1  0.796  0.611  0.204  1.0
  Zr  Zr1  1  0.296  0.112  0.704  1.0
  Mn  Mn2  1  0.512  0.464  0.488  1.0
  Mn  Mn3  1  0.012  0.963  0.987  1.0
  O  O4  1  0.186  0.309  0.415  1.0
  O  O5  1  0.920  0.309  0.814  1.0
  O  O6  1  0.420  0.809  0.915  1.0
  O  O7  1  0.585  0.309  0.080  1.0
  O  O8  1  0.085  0.809  0.314  1.0
  O  O9  1  0.686  0.809  0.579  1.0
[/CIF]
.
The structure described by MnZrO3 is Ilmenite-like structured and crystallizes in the trigonal R3c space group. Zr(1) is bonded to six equivalent O(1) atoms to form corner-sharing ZrO6 octahedra. The corner-sharing octahedral tilt angles are 42°. Mn(1) is bonded in a 6-coordinate geometry to six equivalent O(1) atoms. O(1) is bonded in a distorted see-saw-like geometry to two equivalent Zr(1) and two equivalent Mn(1) atoms. is represented by the CIF card [CIF]
data_ZrMnO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.472
_cell_length_b   5.812
_cell_length_c   5.472
_cell_angle_alpha   118.076
_cell_angle_beta   119.998
_cell_angle_gamma   61.920
_symmetry_Int_Tables_number   1
_cell_volume   126.521
_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
  Zr  Zr0  1  0.796  0.611  0.204  1.0
  Zr  Zr1  1  0.296  0.112  0.704  1.0
  Mn  Mn2  1  0.512  0.464  0.488  1.0
  Mn  Mn3  1  0.012  0.963  0.987  1.0
  O  O4  1  0.186  0.309  0.415  1.0
  O  O5  1  0.920  0.309  0.814  1.0
  O  O6  1  0.420  0.809  0.915  1.0
  O  O7  1  0.585  0.309  0.080  1.0
  O  O8  1  0.085  0.809  0.314  1.0
  O  O9  1  0.686  0.809  0.579  1.0
[/CIF]
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