The structure described by Nd3BWO9 crystallizes in the hexagonal P6_3 space group. Nd(1) is bonded in a 8-coordinate geometry to two equivalent O(2), three equivalent O(1), and three equivalent O(3) atoms. W(1) is bonded in a distorted octahedral geometry to three equivalent O(2) and three equivalent O(3) atoms. B(1) is bonded in a trigonal planar geometry to three equivalent O(1) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to three equivalent Nd(1) and one B(1) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to two equivalent Nd(1) and one W(1) atom. In the third O site, O(3) is bonded to three equivalent Nd(1) and one W(1) atom to form a mixture of distorted edge and corner-sharing ONd3W tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_Nd3BWO9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.799
_cell_length_b   8.799
_cell_length_c   5.593
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   375.027
_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  0.724  0.644  0.204  1.0
  Nd  Nd1  1  0.080  0.724  0.704  1.0
  Nd  Nd2  1  0.356  0.080  0.204  1.0
  Nd  Nd3  1  0.920  0.276  0.204  1.0
  Nd  Nd4  1  0.644  0.920  0.704  1.0
  Nd  Nd5  1  0.276  0.356  0.704  1.0
  B  B6  1  0.000  0.000  0.369  1.0
  B  B7  1  0.000  0.000  0.869  1.0
  W  W8  1  0.667  0.333  0.747  1.0
  W  W9  1  0.333  0.667  0.247  1.0
  O  O10  1  0.176  0.048  0.861  1.0
  O  O11  1  0.794  0.534  0.544  1.0
  O  O12  1  0.127  0.176  0.361  1.0
  O  O13  1  0.740  0.206  0.544  1.0
  O  O14  1  0.135  0.520  0.471  1.0
  O  O15  1  0.615  0.135  0.971  1.0
  O  O16  1  0.260  0.794  0.044  1.0
  O  O17  1  0.952  0.127  0.861  1.0
  O  O18  1  0.206  0.466  0.044  1.0
  O  O19  1  0.865  0.480  0.971  1.0
  O  O20  1  0.873  0.824  0.861  1.0
  O  O21  1  0.534  0.740  0.044  1.0
  O  O22  1  0.520  0.385  0.971  1.0
  O  O23  1  0.385  0.865  0.471  1.0
  O  O24  1  0.048  0.873  0.361  1.0
  O  O25  1  0.480  0.615  0.471  1.0
  O  O26  1  0.466  0.260  0.544  1.0
  O  O27  1  0.824  0.952  0.361  1.0
[/CIF]
.
The structure described by Nd3BWO9 crystallizes in the hexagonal P6_3 space group. Nd(1) is bonded in a 8-coordinate geometry to two equivalent O(2), three equivalent O(1), and three equivalent O(3) atoms. W(1) is bonded in a distorted octahedral geometry to three equivalent O(2) and three equivalent O(3) atoms. B(1) is bonded in a trigonal planar geometry to three equivalent O(1) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to three equivalent Nd(1) and one B(1) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to two equivalent Nd(1) and one W(1) atom. In the third O site, O(3) is bonded to three equivalent Nd(1) and one W(1) atom to form a mixture of distorted edge and corner-sharing ONd3W tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_Nd3BWO9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.799
_cell_length_b   8.799
_cell_length_c   5.593
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   375.027
_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  0.724  0.644  0.204  1.0
  Nd  Nd1  1  0.080  0.724  0.704  1.0
  Nd  Nd2  1  0.356  0.080  0.204  1.0
  Nd  Nd3  1  0.920  0.276  0.204  1.0
  Nd  Nd4  1  0.644  0.920  0.704  1.0
  Nd  Nd5  1  0.276  0.356  0.704  1.0
  B  B6  1  0.000  0.000  0.369  1.0
  B  B7  1  0.000  0.000  0.869  1.0
  W  W8  1  0.667  0.333  0.747  1.0
  W  W9  1  0.333  0.667  0.247  1.0
  O  O10  1  0.176  0.048  0.861  1.0
  O  O11  1  0.794  0.534  0.544  1.0
  O  O12  1  0.127  0.176  0.361  1.0
  O  O13  1  0.740  0.206  0.544  1.0
  O  O14  1  0.135  0.520  0.471  1.0
  O  O15  1  0.615  0.135  0.971  1.0
  O  O16  1  0.260  0.794  0.044  1.0
  O  O17  1  0.952  0.127  0.861  1.0
  O  O18  1  0.206  0.466  0.044  1.0
  O  O19  1  0.865  0.480  0.971  1.0
  O  O20  1  0.873  0.824  0.861  1.0
  O  O21  1  0.534  0.740  0.044  1.0
  O  O22  1  0.520  0.385  0.971  1.0
  O  O23  1  0.385  0.865  0.471  1.0
  O  O24  1  0.048  0.873  0.361  1.0
  O  O25  1  0.480  0.615  0.471  1.0
  O  O26  1  0.466  0.260  0.544  1.0
  O  O27  1  0.824  0.952  0.361  1.0
[/CIF]
.