The crystal structure described by NdOF is Fluorite-derived structured and crystallizes in the trigonal R-3m space group. Nd(1) is bonded in a body-centered cubic geometry to four equivalent O(1) and four equivalent F(1) atoms. O(1) is bonded to four equivalent Nd(1) atoms to form ONd4 tetrahedra that share corners with six equivalent O(1)Nd4 tetrahedra, corners with ten equivalent F(1)Nd4 tetrahedra, edges with three equivalent O(1)Nd4 tetrahedra, and edges with three equivalent F(1)Nd4 tetrahedra. F(1) is bonded to four equivalent Nd(1) atoms to form FNd4 tetrahedra that share corners with six equivalent F(1)Nd4 tetrahedra, corners with ten equivalent O(1)Nd4 tetrahedra, edges with three equivalent O(1)Nd4 tetrahedra, and edges with three equivalent F(1)Nd4 tetrahedra. is represented by the CIF file [CIF]
data_NdOF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.962
_cell_length_b   6.962
_cell_length_c   6.962
_cell_angle_alpha   33.058
_cell_angle_beta   33.058
_cell_angle_gamma   33.058
_symmetry_Int_Tables_number   1
_cell_volume   89.361
_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
  Nd  Nd0  1  0.258  0.258  0.258  1.0
  Nd  Nd1  1  0.742  0.742  0.742  1.0
  O  O2  1  0.378  0.378  0.378  1.0
  O  O3  1  0.622  0.622  0.622  1.0
  F  F4  1  0.130  0.130  0.130  1.0
  F  F5  1  0.870  0.870  0.870  1.0
[/CIF]
.
The crystal structure described by NdOF is Fluorite-derived structured and crystallizes in the trigonal R-3m space group. Nd(1) is bonded in a body-centered cubic geometry to four equivalent O(1) and four equivalent F(1) atoms. O(1) is bonded to four equivalent Nd(1) atoms to form ONd4 tetrahedra that share corners with six equivalent O(1)Nd4 tetrahedra, corners with ten equivalent F(1)Nd4 tetrahedra, edges with three equivalent O(1)Nd4 tetrahedra, and edges with three equivalent F(1)Nd4 tetrahedra. F(1) is bonded to four equivalent Nd(1) atoms to form FNd4 tetrahedra that share corners with six equivalent F(1)Nd4 tetrahedra, corners with ten equivalent O(1)Nd4 tetrahedra, edges with three equivalent O(1)Nd4 tetrahedra, and edges with three equivalent F(1)Nd4 tetrahedra. is represented by the CIF file [CIF]
data_NdOF
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.962
_cell_length_b   6.962
_cell_length_c   6.962
_cell_angle_alpha   33.058
_cell_angle_beta   33.058
_cell_angle_gamma   33.058
_symmetry_Int_Tables_number   1
_cell_volume   89.361
_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
  Nd  Nd0  1  0.258  0.258  0.258  1.0
  Nd  Nd1  1  0.742  0.742  0.742  1.0
  O  O2  1  0.378  0.378  0.378  1.0
  O  O3  1  0.622  0.622  0.622  1.0
  F  F4  1  0.130  0.130  0.130  1.0
  F  F5  1  0.870  0.870  0.870  1.0
[/CIF]
.