The material structure described by CdNNi3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. Ni(1) is bonded in a linear geometry to four equivalent Cd(1) and two equivalent N(1) atoms. Cd(1) is bonded to twelve equivalent Ni(1) atoms to form CdNi12 cuboctahedra that share corners with twelve equivalent Cd(1)Ni12 cuboctahedra, faces with six equivalent Cd(1)Ni12 cuboctahedra, and faces with eight equivalent N(1)Ni6 octahedra. N(1) is bonded to six equivalent Ni(1) atoms to form NNi6 octahedra that share corners with six equivalent N(1)Ni6 octahedra and faces with eight equivalent Cd(1)Ni12 cuboctahedra. The corner-sharing octahedra are not tilted. is represented by the CIF file [CIF]
data_CdNi3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.822
_cell_length_b   3.822
_cell_length_c   3.822
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   55.810
_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
  Cd  Cd0  1  0.000  0.000  0.000  1.0
  Ni  Ni1  1  0.500  0.500  0.000  1.0
  Ni  Ni2  1  0.500  0.000  0.500  1.0
  Ni  Ni3  1  0.000  0.500  0.500  1.0
  N  N4  1  0.500  0.500  0.500  1.0
[/CIF]
.
The material structure described by CdNNi3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. Ni(1) is bonded in a linear geometry to four equivalent Cd(1) and two equivalent N(1) atoms. Cd(1) is bonded to twelve equivalent Ni(1) atoms to form CdNi12 cuboctahedra that share corners with twelve equivalent Cd(1)Ni12 cuboctahedra, faces with six equivalent Cd(1)Ni12 cuboctahedra, and faces with eight equivalent N(1)Ni6 octahedra. N(1) is bonded to six equivalent Ni(1) atoms to form NNi6 octahedra that share corners with six equivalent N(1)Ni6 octahedra and faces with eight equivalent Cd(1)Ni12 cuboctahedra. The corner-sharing octahedra are not tilted. is represented by the CIF file [CIF]
data_CdNi3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.822
_cell_length_b   3.822
_cell_length_c   3.822
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   55.810
_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
  Cd  Cd0  1  0.000  0.000  0.000  1.0
  Ni  Ni1  1  0.500  0.500  0.000  1.0
  Ni  Ni2  1  0.500  0.000  0.500  1.0
  Ni  Ni3  1  0.000  0.500  0.500  1.0
  N  N4  1  0.500  0.500  0.500  1.0
[/CIF]
.