The material described by AsPOCl3F5 is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four AsPOCl3F5 clusters. As(1) is bonded to one O(1), one F(1), one F(2), one F(3), one F(4), and one F(5) atom to form AsOF5 octahedra that share  a cornercorner with one P(1)Cl3O tetrahedra. P(1) is bonded to one O(1), one Cl(1), one Cl(2), and one Cl(3) atom to form PCl3O tetrahedra that share  a cornercorner with one As(1)OF5 octahedra. The corner-sharing octahedral tilt angles are 45°. O(1) is bonded in a distorted bent 150 degrees geometry to one As(1) and one P(1) atom. There are three inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one P(1) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one P(1) atom. In the third Cl site, Cl(3) is bonded in a single-bond geometry to one P(1) atom. There are five inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to one As(1) atom. In the second F site, F(2) is bonded in a single-bond geometry to one As(1) atom. In the third F site, F(3) is bonded in a single-bond geometry to one As(1) atom. In the fourth F site, F(4) is bonded in a single-bond geometry to one As(1) atom. In the fifth F site, F(5) is bonded in a single-bond geometry to one As(1) atom. is represented by the CIF card [CIF]
data_AsPCl3OF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   20.058
_cell_length_b   6.174
_cell_length_c   8.461
_cell_angle_alpha   63.252
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   935.698
_cell_formula_units_Z   4
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
  As  As0  1  0.123  0.135  0.818  1.0
  As  As1  1  0.377  0.135  0.318  1.0
  As  As2  1  0.877  0.865  0.182  1.0
  As  As3  1  0.623  0.865  0.682  1.0
  P  P4  1  0.390  0.182  0.682  1.0
  P  P5  1  0.610  0.818  0.318  1.0
  P  P6  1  0.110  0.182  0.182  1.0
  P  P7  1  0.890  0.818  0.818  1.0
  Cl  Cl8  1  0.309  0.373  0.658  1.0
  Cl  Cl9  1  0.871  0.153  0.641  1.0
  Cl  Cl10  1  0.191  0.373  0.158  1.0
  Cl  Cl11  1  0.371  0.847  0.859  1.0
  Cl  Cl12  1  0.129  0.847  0.359  1.0
  Cl  Cl13  1  0.540  0.691  0.220  1.0
  Cl  Cl14  1  0.040  0.309  0.280  1.0
  Cl  Cl15  1  0.460  0.309  0.780  1.0
  Cl  Cl16  1  0.691  0.627  0.342  1.0
  Cl  Cl17  1  0.809  0.627  0.842  1.0
  Cl  Cl18  1  0.960  0.691  0.720  1.0
  Cl  Cl19  1  0.629  0.153  0.141  1.0
  O  O20  1  0.915  0.799  0.992  1.0
  O  O21  1  0.585  0.799  0.492  1.0
  O  O22  1  0.085  0.201  0.008  1.0
  O  O23  1  0.415  0.201  0.508  1.0
  F  F24  1  0.695  0.981  0.549  1.0
  F  F25  1  0.086  0.847  0.924  1.0
  F  F26  1  0.655  0.916  0.854  1.0
  F  F27  1  0.845  0.916  0.354  1.0
  F  F28  1  0.452  0.258  0.206  1.0
  F  F29  1  0.657  0.571  0.770  1.0
  F  F30  1  0.843  0.571  0.270  1.0
  F  F31  1  0.805  0.981  0.049  1.0
  F  F32  1  0.155  0.084  0.646  1.0
  F  F33  1  0.952  0.742  0.294  1.0
  F  F34  1  0.586  0.153  0.576  1.0
  F  F35  1  0.414  0.847  0.424  1.0
  F  F36  1  0.305  0.019  0.451  1.0
  F  F37  1  0.195  0.019  0.951  1.0
  F  F38  1  0.914  0.153  0.076  1.0
  F  F39  1  0.157  0.429  0.730  1.0
  F  F40  1  0.048  0.258  0.706  1.0
  F  F41  1  0.548  0.742  0.794  1.0
  F  F42  1  0.343  0.429  0.230  1.0
  F  F43  1  0.345  0.084  0.146  1.0
[/CIF]
.
The material described by AsPOCl3F5 is Indium-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four AsPOCl3F5 clusters. As(1) is bonded to one O(1), one F(1), one F(2), one F(3), one F(4), and one F(5) atom to form AsOF5 octahedra that share  a cornercorner with one P(1)Cl3O tetrahedra. P(1) is bonded to one O(1), one Cl(1), one Cl(2), and one Cl(3) atom to form PCl3O tetrahedra that share  a cornercorner with one As(1)OF5 octahedra. The corner-sharing octahedral tilt angles are 45°. O(1) is bonded in a distorted bent 150 degrees geometry to one As(1) and one P(1) atom. There are three inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one P(1) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one P(1) atom. In the third Cl site, Cl(3) is bonded in a single-bond geometry to one P(1) atom. There are five inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to one As(1) atom. In the second F site, F(2) is bonded in a single-bond geometry to one As(1) atom. In the third F site, F(3) is bonded in a single-bond geometry to one As(1) atom. In the fourth F site, F(4) is bonded in a single-bond geometry to one As(1) atom. In the fifth F site, F(5) is bonded in a single-bond geometry to one As(1) atom. is represented by the CIF card [CIF]
data_AsPCl3OF5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   20.058
_cell_length_b   6.174
_cell_length_c   8.461
_cell_angle_alpha   63.252
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   935.698
_cell_formula_units_Z   4
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
  As  As0  1  0.123  0.135  0.818  1.0
  As  As1  1  0.377  0.135  0.318  1.0
  As  As2  1  0.877  0.865  0.182  1.0
  As  As3  1  0.623  0.865  0.682  1.0
  P  P4  1  0.390  0.182  0.682  1.0
  P  P5  1  0.610  0.818  0.318  1.0
  P  P6  1  0.110  0.182  0.182  1.0
  P  P7  1  0.890  0.818  0.818  1.0
  Cl  Cl8  1  0.309  0.373  0.658  1.0
  Cl  Cl9  1  0.871  0.153  0.641  1.0
  Cl  Cl10  1  0.191  0.373  0.158  1.0
  Cl  Cl11  1  0.371  0.847  0.859  1.0
  Cl  Cl12  1  0.129  0.847  0.359  1.0
  Cl  Cl13  1  0.540  0.691  0.220  1.0
  Cl  Cl14  1  0.040  0.309  0.280  1.0
  Cl  Cl15  1  0.460  0.309  0.780  1.0
  Cl  Cl16  1  0.691  0.627  0.342  1.0
  Cl  Cl17  1  0.809  0.627  0.842  1.0
  Cl  Cl18  1  0.960  0.691  0.720  1.0
  Cl  Cl19  1  0.629  0.153  0.141  1.0
  O  O20  1  0.915  0.799  0.992  1.0
  O  O21  1  0.585  0.799  0.492  1.0
  O  O22  1  0.085  0.201  0.008  1.0
  O  O23  1  0.415  0.201  0.508  1.0
  F  F24  1  0.695  0.981  0.549  1.0
  F  F25  1  0.086  0.847  0.924  1.0
  F  F26  1  0.655  0.916  0.854  1.0
  F  F27  1  0.845  0.916  0.354  1.0
  F  F28  1  0.452  0.258  0.206  1.0
  F  F29  1  0.657  0.571  0.770  1.0
  F  F30  1  0.843  0.571  0.270  1.0
  F  F31  1  0.805  0.981  0.049  1.0
  F  F32  1  0.155  0.084  0.646  1.0
  F  F33  1  0.952  0.742  0.294  1.0
  F  F34  1  0.586  0.153  0.576  1.0
  F  F35  1  0.414  0.847  0.424  1.0
  F  F36  1  0.305  0.019  0.451  1.0
  F  F37  1  0.195  0.019  0.951  1.0
  F  F38  1  0.914  0.153  0.076  1.0
  F  F39  1  0.157  0.429  0.730  1.0
  F  F40  1  0.048  0.258  0.706  1.0
  F  F41  1  0.548  0.742  0.794  1.0
  F  F42  1  0.343  0.429  0.230  1.0
  F  F43  1  0.345  0.084  0.146  1.0
[/CIF]
.