The material structure described by Th5OF19 crystallizes in the orthorhombic Cmcm space group. There are three inequivalent Th sites. In the first Th site, Th(1) is bonded in a 9-coordinate geometry to one O(1), two equivalent F(3), two equivalent F(5), and four equivalent F(6) atoms. In the second Th site, Th(2) is bonded in a 10-coordinate geometry to one F(5), one F(8), two equivalent F(2), two equivalent F(4), and four equivalent F(1) atoms. In the third Th site, Th(3) is bonded in a 9-coordinate geometry to one F(4), two equivalent F(1), two equivalent F(6), two equivalent F(7), and two equivalent F(8) atoms. O(1) is bonded in a single-bond geometry to one Th(1) atom. There are eight inequivalent F sites. In the first F site, F(2) is bonded in a bent 150 degrees geometry to two equivalent Th(2) atoms. In the second F site, F(3) is bonded in a linear geometry to two equivalent Th(1) atoms. In the third F site, F(4) is bonded in a trigonal planar geometry to one Th(3) and two equivalent Th(2) atoms. In the fourth F site, F(5) is bonded in a distorted linear geometry to one Th(1) and one Th(2) atom. In the fifth F site, F(6) is bonded in a distorted linear geometry to one Th(1) and one Th(3) atom. In the sixth F site, F(7) is bonded in a bent 120 degrees geometry to two equivalent Th(3) atoms. In the seventh F site, F(1) is bonded in a trigonal planar geometry to one Th(3) and two equivalent Th(2) atoms. In the eighth F site, F(8) is bonded in a trigonal planar geometry to one Th(2) and two equivalent Th(3) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Th5OF19
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.423
_cell_length_b   12.423
_cell_length_c   8.303
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   145.719
_symmetry_Int_Tables_number   1
_cell_volume   721.761
_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
  Th  Th0  1  0.130  0.130  0.250  1.0
  Th  Th1  1  0.870  0.870  0.750  1.0
  Th  Th2  1  0.822  0.210  0.250  1.0
  Th  Th3  1  0.178  0.790  0.750  1.0
  Th  Th4  1  0.210  0.822  0.250  1.0
  Th  Th5  1  0.790  0.178  0.750  1.0
  Th  Th6  1  0.633  0.367  0.000  1.0
  Th  Th7  1  0.367  0.633  0.000  1.0
  Th  Th8  1  0.367  0.633  0.500  1.0
  Th  Th9  1  0.633  0.367  0.500  1.0
  O  O10  1  0.830  0.830  0.250  1.0
  O  O11  1  0.170  0.170  0.750  1.0
  F  F12  1  0.993  0.661  0.013  1.0
  F  F13  1  0.007  0.339  0.987  1.0
  F  F14  1  0.007  0.339  0.513  1.0
  F  F15  1  0.661  0.993  0.487  1.0
  F  F16  1  0.993  0.661  0.487  1.0
  F  F17  1  0.339  0.007  0.513  1.0
  F  F18  1  0.339  0.007  0.987  1.0
  F  F19  1  0.661  0.993  0.013  1.0
  F  F20  1  0.948  0.488  0.250  1.0
  F  F21  1  0.052  0.512  0.750  1.0
  F  F22  1  0.488  0.948  0.250  1.0
  F  F23  1  0.512  0.052  0.750  1.0
  F  F24  1  0.000  0.000  0.000  1.0
  F  F25  1  0.000  0.000  0.500  1.0
  F  F26  1  0.738  0.262  0.000  1.0
  F  F27  1  0.262  0.738  0.000  1.0
  F  F28  1  0.262  0.738  0.500  1.0
  F  F29  1  0.738  0.262  0.500  1.0
  F  F30  1  0.930  0.134  0.250  1.0
  F  F31  1  0.070  0.866  0.750  1.0
  F  F32  1  0.134  0.930  0.250  1.0
  F  F33  1  0.866  0.070  0.750  1.0
  F  F34  1  0.269  0.390  0.085  1.0
  F  F35  1  0.731  0.610  0.915  1.0
  F  F36  1  0.731  0.610  0.585  1.0
  F  F37  1  0.390  0.269  0.415  1.0
  F  F38  1  0.269  0.390  0.415  1.0
  F  F39  1  0.610  0.731  0.585  1.0
  F  F40  1  0.610  0.731  0.915  1.0
  F  F41  1  0.390  0.269  0.085  1.0
  F  F42  1  0.749  0.520  0.250  1.0
  F  F43  1  0.251  0.480  0.750  1.0
  F  F44  1  0.520  0.749  0.250  1.0
  F  F45  1  0.480  0.251  0.750  1.0
  F  F46  1  0.179  0.519  0.250  1.0
  F  F47  1  0.821  0.481  0.750  1.0
  F  F48  1  0.519  0.179  0.250  1.0
  F  F49  1  0.481  0.821  0.750  1.0
[/CIF]
.
The material structure described by Th5OF19 crystallizes in the orthorhombic Cmcm space group. There are three inequivalent Th sites. In the first Th site, Th(1) is bonded in a 9-coordinate geometry to one O(1), two equivalent F(3), two equivalent F(5), and four equivalent F(6) atoms. In the second Th site, Th(2) is bonded in a 10-coordinate geometry to one F(5), one F(8), two equivalent F(2), two equivalent F(4), and four equivalent F(1) atoms. In the third Th site, Th(3) is bonded in a 9-coordinate geometry to one F(4), two equivalent F(1), two equivalent F(6), two equivalent F(7), and two equivalent F(8) atoms. O(1) is bonded in a single-bond geometry to one Th(1) atom. There are eight inequivalent F sites. In the first F site, F(2) is bonded in a bent 150 degrees geometry to two equivalent Th(2) atoms. In the second F site, F(3) is bonded in a linear geometry to two equivalent Th(1) atoms. In the third F site, F(4) is bonded in a trigonal planar geometry to one Th(3) and two equivalent Th(2) atoms. In the fourth F site, F(5) is bonded in a distorted linear geometry to one Th(1) and one Th(2) atom. In the fifth F site, F(6) is bonded in a distorted linear geometry to one Th(1) and one Th(3) atom. In the sixth F site, F(7) is bonded in a bent 120 degrees geometry to two equivalent Th(3) atoms. In the seventh F site, F(1) is bonded in a trigonal planar geometry to one Th(3) and two equivalent Th(2) atoms. In the eighth F site, F(8) is bonded in a trigonal planar geometry to one Th(2) and two equivalent Th(3) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Th5OF19
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.423
_cell_length_b   12.423
_cell_length_c   8.303
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   145.719
_symmetry_Int_Tables_number   1
_cell_volume   721.761
_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
  Th  Th0  1  0.130  0.130  0.250  1.0
  Th  Th1  1  0.870  0.870  0.750  1.0
  Th  Th2  1  0.822  0.210  0.250  1.0
  Th  Th3  1  0.178  0.790  0.750  1.0
  Th  Th4  1  0.210  0.822  0.250  1.0
  Th  Th5  1  0.790  0.178  0.750  1.0
  Th  Th6  1  0.633  0.367  0.000  1.0
  Th  Th7  1  0.367  0.633  0.000  1.0
  Th  Th8  1  0.367  0.633  0.500  1.0
  Th  Th9  1  0.633  0.367  0.500  1.0
  O  O10  1  0.830  0.830  0.250  1.0
  O  O11  1  0.170  0.170  0.750  1.0
  F  F12  1  0.993  0.661  0.013  1.0
  F  F13  1  0.007  0.339  0.987  1.0
  F  F14  1  0.007  0.339  0.513  1.0
  F  F15  1  0.661  0.993  0.487  1.0
  F  F16  1  0.993  0.661  0.487  1.0
  F  F17  1  0.339  0.007  0.513  1.0
  F  F18  1  0.339  0.007  0.987  1.0
  F  F19  1  0.661  0.993  0.013  1.0
  F  F20  1  0.948  0.488  0.250  1.0
  F  F21  1  0.052  0.512  0.750  1.0
  F  F22  1  0.488  0.948  0.250  1.0
  F  F23  1  0.512  0.052  0.750  1.0
  F  F24  1  0.000  0.000  0.000  1.0
  F  F25  1  0.000  0.000  0.500  1.0
  F  F26  1  0.738  0.262  0.000  1.0
  F  F27  1  0.262  0.738  0.000  1.0
  F  F28  1  0.262  0.738  0.500  1.0
  F  F29  1  0.738  0.262  0.500  1.0
  F  F30  1  0.930  0.134  0.250  1.0
  F  F31  1  0.070  0.866  0.750  1.0
  F  F32  1  0.134  0.930  0.250  1.0
  F  F33  1  0.866  0.070  0.750  1.0
  F  F34  1  0.269  0.390  0.085  1.0
  F  F35  1  0.731  0.610  0.915  1.0
  F  F36  1  0.731  0.610  0.585  1.0
  F  F37  1  0.390  0.269  0.415  1.0
  F  F38  1  0.269  0.390  0.415  1.0
  F  F39  1  0.610  0.731  0.585  1.0
  F  F40  1  0.610  0.731  0.915  1.0
  F  F41  1  0.390  0.269  0.085  1.0
  F  F42  1  0.749  0.520  0.250  1.0
  F  F43  1  0.251  0.480  0.750  1.0
  F  F44  1  0.520  0.749  0.250  1.0
  F  F45  1  0.480  0.251  0.750  1.0
  F  F46  1  0.179  0.519  0.250  1.0
  F  F47  1  0.821  0.481  0.750  1.0
  F  F48  1  0.519  0.179  0.250  1.0
  F  F49  1  0.481  0.821  0.750  1.0
[/CIF]
.