The material structure described by NaNdB6O13 crystallizes in the triclinic P-1 space group. Na(1) is bonded in a 3-coordinate geometry to one O(12), one O(13), and one O(3) atom. Nd(1) is bonded in a 7-coordinate geometry to one O(1), one O(11), one O(2), one O(4), one O(5), one O(6), and one O(9) atom. There are six inequivalent B sites. In the first B site, B(1) is bonded in a tetrahedral geometry to one O(11), one O(2), one O(4), and one O(6) atom. In the second B site, B(2) is bonded in a trigonal planar geometry to one O(4), one O(8), and one O(9) atom. In the third B site, B(3) is bonded in a trigonal planar geometry to one O(1), one O(2), and one O(5) atom. In the fourth B site, B(4) is bonded in a trigonal planar geometry to one O(10), one O(3), and one O(8) atom. In the fifth B site, B(5) is bonded in a trigonal planar geometry to one O(1), one O(13), and one O(7) atom. In the sixth B site, B(6) is bonded in a trigonal planar geometry to one O(12), one O(3), and one O(9) atom. There are thirteen inequivalent O sites. In the first O site, O(1) is bonded in a 2-coordinate geometry to one Nd(1), one B(3), and one B(5) atom. In the second O site, O(2) is bonded in a distorted bent 120 degrees geometry to one Nd(1), one B(1), and one B(3) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Na(1), one B(4), and one B(6) atom. In the fourth O site, O(4) is bonded in a distorted bent 120 degrees geometry to one Nd(1), one B(1), and one B(2) atom. In the fifth O site, O(5) is bonded in a distorted bent 120 degrees geometry to one Nd(1) and one B(3) atom. In the sixth O site, O(6) is bonded in a distorted bent 120 degrees geometry to one Nd(1) and one B(1) atom. In the seventh O site, O(7) is bonded in a distorted single-bond geometry to one B(5) atom. In the eighth O site, O(8) is bonded in a bent 120 degrees geometry to one B(2) and one B(4) atom. In the ninth O site, O(9) is bonded in a distorted bent 120 degrees geometry to one Nd(1), one B(2), and one B(6) atom. In the tenth O site, O(10) is bonded in a distorted single-bond geometry to one B(4) atom. In the eleventh O site, O(11) is bonded in a distorted bent 150 degrees geometry to one Nd(1) and one B(1) atom. In the twelfth O site, O(12) is bonded in a distorted water-like geometry to one Na(1) and one B(6) atom. In the thirteenth O site, O(13) is bonded in a distorted bent 150 degrees geometry to one Na(1) and one B(5) atom. is represented by the CIF card [CIF]
data_NaNdB6O13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.782
_cell_length_b   7.411
_cell_length_c   11.823
_cell_angle_alpha   92.819
_cell_angle_beta   108.378
_cell_angle_gamma   89.951
_symmetry_Int_Tables_number   1
_cell_volume   563.249
_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
  Na  Na0  1  0.811  0.524  0.609  1.0
  Na  Na1  1  0.189  0.476  0.391  1.0
  Nd  Nd2  1  0.727  0.764  0.926  1.0
  Nd  Nd3  1  0.273  0.236  0.074  1.0
  B  B4  1  0.236  0.734  0.959  1.0
  B  B5  1  0.764  0.266  0.041  1.0
  B  B6  1  0.459  0.604  0.156  1.0
  B  B7  1  0.541  0.396  0.844  1.0
  B  B8  1  0.127  0.880  0.127  1.0
  B  B9  1  0.873  0.120  0.873  1.0
  B  B10  1  0.780  0.724  0.282  1.0
  B  B11  1  0.220  0.276  0.718  1.0
  B  B12  1  0.813  0.971  0.663  1.0
  B  B13  1  0.187  0.029  0.337  1.0
  B  B14  1  0.361  0.536  0.655  1.0
  B  B15  1  0.639  0.464  0.345  1.0
  O  O16  1  0.788  0.991  0.775  1.0
  O  O17  1  0.212  0.009  0.225  1.0
  O  O18  1  0.226  0.902  0.041  1.0
  O  O19  1  0.774  0.098  0.959  1.0
  O  O20  1  0.817  0.574  0.347  1.0
  O  O21  1  0.183  0.426  0.653  1.0
  O  O22  1  0.313  0.578  0.047  1.0
  O  O23  1  0.687  0.422  0.953  1.0
  O  O24  1  0.971  0.765  0.113  1.0
  O  O25  1  0.029  0.235  0.887  1.0
  O  O26  1  0.034  0.684  0.879  1.0
  O  O27  1  0.966  0.316  0.121  1.0
  O  O28  1  0.106  0.874  0.382  1.0
  O  O29  1  0.894  0.126  0.618  1.0
  O  O30  1  0.606  0.741  0.183  1.0
  O  O31  1  0.394  0.259  0.817  1.0
  O  O32  1  0.542  0.518  0.758  1.0
  O  O33  1  0.458  0.482  0.242  1.0
  O  O34  1  0.893  0.886  0.308  1.0
  O  O35  1  0.107  0.114  0.692  1.0
  O  O36  1  0.375  0.766  0.895  1.0
  O  O37  1  0.625  0.234  0.105  1.0
  O  O38  1  0.366  0.631  0.567  1.0
  O  O39  1  0.634  0.369  0.433  1.0
  O  O40  1  0.767  0.826  0.590  1.0
  O  O41  1  0.233  0.174  0.410  1.0
[/CIF]
.
The material structure described by NaNdB6O13 crystallizes in the triclinic P-1 space group. Na(1) is bonded in a 3-coordinate geometry to one O(12), one O(13), and one O(3) atom. Nd(1) is bonded in a 7-coordinate geometry to one O(1), one O(11), one O(2), one O(4), one O(5), one O(6), and one O(9) atom. There are six inequivalent B sites. In the first B site, B(1) is bonded in a tetrahedral geometry to one O(11), one O(2), one O(4), and one O(6) atom. In the second B site, B(2) is bonded in a trigonal planar geometry to one O(4), one O(8), and one O(9) atom. In the third B site, B(3) is bonded in a trigonal planar geometry to one O(1), one O(2), and one O(5) atom. In the fourth B site, B(4) is bonded in a trigonal planar geometry to one O(10), one O(3), and one O(8) atom. In the fifth B site, B(5) is bonded in a trigonal planar geometry to one O(1), one O(13), and one O(7) atom. In the sixth B site, B(6) is bonded in a trigonal planar geometry to one O(12), one O(3), and one O(9) atom. There are thirteen inequivalent O sites. In the first O site, O(1) is bonded in a 2-coordinate geometry to one Nd(1), one B(3), and one B(5) atom. In the second O site, O(2) is bonded in a distorted bent 120 degrees geometry to one Nd(1), one B(1), and one B(3) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Na(1), one B(4), and one B(6) atom. In the fourth O site, O(4) is bonded in a distorted bent 120 degrees geometry to one Nd(1), one B(1), and one B(2) atom. In the fifth O site, O(5) is bonded in a distorted bent 120 degrees geometry to one Nd(1) and one B(3) atom. In the sixth O site, O(6) is bonded in a distorted bent 120 degrees geometry to one Nd(1) and one B(1) atom. In the seventh O site, O(7) is bonded in a distorted single-bond geometry to one B(5) atom. In the eighth O site, O(8) is bonded in a bent 120 degrees geometry to one B(2) and one B(4) atom. In the ninth O site, O(9) is bonded in a distorted bent 120 degrees geometry to one Nd(1), one B(2), and one B(6) atom. In the tenth O site, O(10) is bonded in a distorted single-bond geometry to one B(4) atom. In the eleventh O site, O(11) is bonded in a distorted bent 150 degrees geometry to one Nd(1) and one B(1) atom. In the twelfth O site, O(12) is bonded in a distorted water-like geometry to one Na(1) and one B(6) atom. In the thirteenth O site, O(13) is bonded in a distorted bent 150 degrees geometry to one Na(1) and one B(5) atom. is represented by the CIF card [CIF]
data_NaNdB6O13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.782
_cell_length_b   7.411
_cell_length_c   11.823
_cell_angle_alpha   92.819
_cell_angle_beta   108.378
_cell_angle_gamma   89.951
_symmetry_Int_Tables_number   1
_cell_volume   563.249
_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
  Na  Na0  1  0.811  0.524  0.609  1.0
  Na  Na1  1  0.189  0.476  0.391  1.0
  Nd  Nd2  1  0.727  0.764  0.926  1.0
  Nd  Nd3  1  0.273  0.236  0.074  1.0
  B  B4  1  0.236  0.734  0.959  1.0
  B  B5  1  0.764  0.266  0.041  1.0
  B  B6  1  0.459  0.604  0.156  1.0
  B  B7  1  0.541  0.396  0.844  1.0
  B  B8  1  0.127  0.880  0.127  1.0
  B  B9  1  0.873  0.120  0.873  1.0
  B  B10  1  0.780  0.724  0.282  1.0
  B  B11  1  0.220  0.276  0.718  1.0
  B  B12  1  0.813  0.971  0.663  1.0
  B  B13  1  0.187  0.029  0.337  1.0
  B  B14  1  0.361  0.536  0.655  1.0
  B  B15  1  0.639  0.464  0.345  1.0
  O  O16  1  0.788  0.991  0.775  1.0
  O  O17  1  0.212  0.009  0.225  1.0
  O  O18  1  0.226  0.902  0.041  1.0
  O  O19  1  0.774  0.098  0.959  1.0
  O  O20  1  0.817  0.574  0.347  1.0
  O  O21  1  0.183  0.426  0.653  1.0
  O  O22  1  0.313  0.578  0.047  1.0
  O  O23  1  0.687  0.422  0.953  1.0
  O  O24  1  0.971  0.765  0.113  1.0
  O  O25  1  0.029  0.235  0.887  1.0
  O  O26  1  0.034  0.684  0.879  1.0
  O  O27  1  0.966  0.316  0.121  1.0
  O  O28  1  0.106  0.874  0.382  1.0
  O  O29  1  0.894  0.126  0.618  1.0
  O  O30  1  0.606  0.741  0.183  1.0
  O  O31  1  0.394  0.259  0.817  1.0
  O  O32  1  0.542  0.518  0.758  1.0
  O  O33  1  0.458  0.482  0.242  1.0
  O  O34  1  0.893  0.886  0.308  1.0
  O  O35  1  0.107  0.114  0.692  1.0
  O  O36  1  0.375  0.766  0.895  1.0
  O  O37  1  0.625  0.234  0.105  1.0
  O  O38  1  0.366  0.631  0.567  1.0
  O  O39  1  0.634  0.369  0.433  1.0
  O  O40  1  0.767  0.826  0.590  1.0
  O  O41  1  0.233  0.174  0.410  1.0
[/CIF]
.