The structure described by Nd14OCl32 crystallizes in the trigonal R-3 space group. There are three inequivalent Nd sites. In the first Nd site, Nd(1) is bonded in a 8-coordinate geometry to one Cl(2), one Cl(3), one Cl(4), one Cl(5), one Cl(6), and three equivalent Cl(1) atoms. In the second Nd site, Nd(2) is bonded in a distorted octahedral geometry to three equivalent Cl(2) and three equivalent Cl(3) atoms. In the third Nd site, Nd(3) is bonded in a 5-coordinate geometry to one O(1), two equivalent Cl(4), and two equivalent Cl(5) atoms. O(1) is bonded in an octahedral geometry to six equivalent Nd(3) atoms. There are six inequivalent Cl sites. In the first Cl site, Cl(5) is bonded in a trigonal non-coplanar geometry to one Nd(1) and two equivalent Nd(3) atoms. In the second Cl site, Cl(6) is bonded in a trigonal non-coplanar geometry to three equivalent Nd(1) atoms. In the third Cl site, Cl(1) is bonded in a trigonal non-coplanar geometry to three equivalent Nd(1) atoms. In the fourth Cl site, Cl(2) is bonded in a water-like geometry to one Nd(1) and one Nd(2) atom. In the fifth Cl site, Cl(3) is bonded in a distorted water-like geometry to one Nd(1) and one Nd(2) atom. In the sixth Cl site, Cl(4) is bonded in a distorted trigonal planar geometry to one Nd(1) and two equivalent Nd(3) atoms. is represented by the CIF card [CIF]
data_Nd14Cl32O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.373
_cell_length_b   12.373
_cell_length_c   12.373
_cell_angle_alpha   57.291
_cell_angle_beta   57.291
_cell_angle_gamma   57.291
_symmetry_Int_Tables_number   1
_cell_volume   1255.849
_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
  Nd  Nd0  1  0.335  0.546  0.812  1.0
  Nd  Nd1  1  0.812  0.335  0.546  1.0
  Nd  Nd2  1  0.546  0.812  0.335  1.0
  Nd  Nd3  1  0.665  0.454  0.188  1.0
  Nd  Nd4  1  0.188  0.665  0.454  1.0
  Nd  Nd5  1  0.454  0.188  0.665  1.0
  Nd  Nd6  1  0.736  0.736  0.736  1.0
  Nd  Nd7  1  0.264  0.264  0.264  1.0
  Nd  Nd8  1  0.881  0.016  0.232  1.0
  Nd  Nd9  1  0.232  0.881  0.016  1.0
  Nd  Nd10  1  0.016  0.232  0.881  1.0
  Nd  Nd11  1  0.119  0.984  0.768  1.0
  Nd  Nd12  1  0.768  0.119  0.984  1.0
  Nd  Nd13  1  0.984  0.768  0.119  1.0
  Cl  Cl14  1  0.236  0.466  0.710  1.0
  Cl  Cl15  1  0.710  0.236  0.466  1.0
  Cl  Cl16  1  0.466  0.710  0.236  1.0
  Cl  Cl17  1  0.764  0.534  0.290  1.0
  Cl  Cl18  1  0.290  0.764  0.534  1.0
  Cl  Cl19  1  0.534  0.290  0.764  1.0
  Cl  Cl20  1  0.937  0.851  0.579  1.0
  Cl  Cl21  1  0.579  0.937  0.851  1.0
  Cl  Cl22  1  0.851  0.579  0.937  1.0
  Cl  Cl23  1  0.063  0.149  0.421  1.0
  Cl  Cl24  1  0.421  0.063  0.149  1.0
  Cl  Cl25  1  0.149  0.421  0.063  1.0
  Cl  Cl26  1  0.393  0.015  0.447  1.0
  Cl  Cl27  1  0.447  0.393  0.015  1.0
  Cl  Cl28  1  0.015  0.447  0.393  1.0
  Cl  Cl29  1  0.607  0.985  0.553  1.0
  Cl  Cl30  1  0.553  0.607  0.985  1.0
  Cl  Cl31  1  0.985  0.553  0.607  1.0
  Cl  Cl32  1  0.375  0.782  0.787  1.0
  Cl  Cl33  1  0.787  0.375  0.782  1.0
  Cl  Cl34  1  0.782  0.787  0.375  1.0
  Cl  Cl35  1  0.625  0.218  0.213  1.0
  Cl  Cl36  1  0.213  0.625  0.218  1.0
  Cl  Cl37  1  0.218  0.213  0.625  1.0
  Cl  Cl38  1  0.072  0.743  0.865  1.0
  Cl  Cl39  1  0.865  0.072  0.743  1.0
  Cl  Cl40  1  0.743  0.865  0.072  1.0
  Cl  Cl41  1  0.928  0.257  0.135  1.0
  Cl  Cl42  1  0.135  0.928  0.257  1.0
  Cl  Cl43  1  0.257  0.135  0.928  1.0
  Cl  Cl44  1  0.589  0.589  0.589  1.0
  Cl  Cl45  1  0.411  0.411  0.411  1.0
  O  O46  1  0.000  0.000  0.000  1.0
[/CIF]
.
The structure described by Nd14OCl32 crystallizes in the trigonal R-3 space group. There are three inequivalent Nd sites. In the first Nd site, Nd(1) is bonded in a 8-coordinate geometry to one Cl(2), one Cl(3), one Cl(4), one Cl(5), one Cl(6), and three equivalent Cl(1) atoms. In the second Nd site, Nd(2) is bonded in a distorted octahedral geometry to three equivalent Cl(2) and three equivalent Cl(3) atoms. In the third Nd site, Nd(3) is bonded in a 5-coordinate geometry to one O(1), two equivalent Cl(4), and two equivalent Cl(5) atoms. O(1) is bonded in an octahedral geometry to six equivalent Nd(3) atoms. There are six inequivalent Cl sites. In the first Cl site, Cl(5) is bonded in a trigonal non-coplanar geometry to one Nd(1) and two equivalent Nd(3) atoms. In the second Cl site, Cl(6) is bonded in a trigonal non-coplanar geometry to three equivalent Nd(1) atoms. In the third Cl site, Cl(1) is bonded in a trigonal non-coplanar geometry to three equivalent Nd(1) atoms. In the fourth Cl site, Cl(2) is bonded in a water-like geometry to one Nd(1) and one Nd(2) atom. In the fifth Cl site, Cl(3) is bonded in a distorted water-like geometry to one Nd(1) and one Nd(2) atom. In the sixth Cl site, Cl(4) is bonded in a distorted trigonal planar geometry to one Nd(1) and two equivalent Nd(3) atoms. is represented by the CIF card [CIF]
data_Nd14Cl32O
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.373
_cell_length_b   12.373
_cell_length_c   12.373
_cell_angle_alpha   57.291
_cell_angle_beta   57.291
_cell_angle_gamma   57.291
_symmetry_Int_Tables_number   1
_cell_volume   1255.849
_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
  Nd  Nd0  1  0.335  0.546  0.812  1.0
  Nd  Nd1  1  0.812  0.335  0.546  1.0
  Nd  Nd2  1  0.546  0.812  0.335  1.0
  Nd  Nd3  1  0.665  0.454  0.188  1.0
  Nd  Nd4  1  0.188  0.665  0.454  1.0
  Nd  Nd5  1  0.454  0.188  0.665  1.0
  Nd  Nd6  1  0.736  0.736  0.736  1.0
  Nd  Nd7  1  0.264  0.264  0.264  1.0
  Nd  Nd8  1  0.881  0.016  0.232  1.0
  Nd  Nd9  1  0.232  0.881  0.016  1.0
  Nd  Nd10  1  0.016  0.232  0.881  1.0
  Nd  Nd11  1  0.119  0.984  0.768  1.0
  Nd  Nd12  1  0.768  0.119  0.984  1.0
  Nd  Nd13  1  0.984  0.768  0.119  1.0
  Cl  Cl14  1  0.236  0.466  0.710  1.0
  Cl  Cl15  1  0.710  0.236  0.466  1.0
  Cl  Cl16  1  0.466  0.710  0.236  1.0
  Cl  Cl17  1  0.764  0.534  0.290  1.0
  Cl  Cl18  1  0.290  0.764  0.534  1.0
  Cl  Cl19  1  0.534  0.290  0.764  1.0
  Cl  Cl20  1  0.937  0.851  0.579  1.0
  Cl  Cl21  1  0.579  0.937  0.851  1.0
  Cl  Cl22  1  0.851  0.579  0.937  1.0
  Cl  Cl23  1  0.063  0.149  0.421  1.0
  Cl  Cl24  1  0.421  0.063  0.149  1.0
  Cl  Cl25  1  0.149  0.421  0.063  1.0
  Cl  Cl26  1  0.393  0.015  0.447  1.0
  Cl  Cl27  1  0.447  0.393  0.015  1.0
  Cl  Cl28  1  0.015  0.447  0.393  1.0
  Cl  Cl29  1  0.607  0.985  0.553  1.0
  Cl  Cl30  1  0.553  0.607  0.985  1.0
  Cl  Cl31  1  0.985  0.553  0.607  1.0
  Cl  Cl32  1  0.375  0.782  0.787  1.0
  Cl  Cl33  1  0.787  0.375  0.782  1.0
  Cl  Cl34  1  0.782  0.787  0.375  1.0
  Cl  Cl35  1  0.625  0.218  0.213  1.0
  Cl  Cl36  1  0.213  0.625  0.218  1.0
  Cl  Cl37  1  0.218  0.213  0.625  1.0
  Cl  Cl38  1  0.072  0.743  0.865  1.0
  Cl  Cl39  1  0.865  0.072  0.743  1.0
  Cl  Cl40  1  0.743  0.865  0.072  1.0
  Cl  Cl41  1  0.928  0.257  0.135  1.0
  Cl  Cl42  1  0.135  0.928  0.257  1.0
  Cl  Cl43  1  0.257  0.135  0.928  1.0
  Cl  Cl44  1  0.589  0.589  0.589  1.0
  Cl  Cl45  1  0.411  0.411  0.411  1.0
  O  O46  1  0.000  0.000  0.000  1.0
[/CIF]
.