The crystal structure described by ZnC6S12(N2O)6(AsF6)2 is Indium-derived structured and crystallizes in the trigonal P-3 space group. The structure is zero-dimensional and consists of two AsF6 clusters and one ZnC6S12(N2O)6 cluster. In each AsF6 cluster, As(1) is bonded in an octahedral geometry to three equivalent F(1) and three equivalent F(2) atoms. There are two inequivalent F sites. In the first F site, F(2) is bonded in a single-bond geometry to one As(1) atom. In the second F site, F(1) is bonded in a single-bond geometry to one As(1) atom. In the ZnC6S12(N2O)6 cluster, Zn(1) is bonded in an octahedral geometry to six equivalent O(1) atoms. C(1) is bonded in a distorted bent 120 degrees geometry to one N(2), one S(2), and one O(1) atom. There are two inequivalent N sites. In the first N site, N(1) is bonded in a water-like geometry to one S(1) and one S(2) atom. In the second N site, N(2) is bonded in a bent 120 degrees geometry to one C(1) and one S(1) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded in a water-like geometry to one N(1) and one N(2) atom. In the second S site, S(2) is bonded in a distorted water-like geometry to one C(1) and one N(1) atom. O(1) is bonded in a distorted bent 150 degrees geometry to one Zn(1) and one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_ZnAs2C6S12N12(OF2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.138
_cell_length_b   12.138
_cell_length_c   6.863
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   875.680
_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
  Zn  Zn0  1  0.000  0.000  0.500  1.0
  As  As1  1  0.667  0.333  0.543  1.0
  As  As2  1  0.333  0.667  0.457  1.0
  C  C3  1  0.243  0.083  0.757  1.0
  C  C4  1  0.757  0.917  0.243  1.0
  C  C5  1  0.160  0.243  0.243  1.0
  C  C6  1  0.083  0.840  0.243  1.0
  C  C7  1  0.917  0.160  0.757  1.0
  C  C8  1  0.840  0.757  0.757  1.0
  S  S9  1  0.308  0.400  0.004  1.0
  S  S10  1  0.400  0.091  0.996  1.0
  S  S11  1  0.300  0.981  0.656  1.0
  S  S12  1  0.318  0.300  0.344  1.0
  S  S13  1  0.091  0.692  0.004  1.0
  S  S14  1  0.981  0.682  0.344  1.0
  S  S15  1  0.019  0.318  0.656  1.0
  S  S16  1  0.909  0.308  0.996  1.0
  S  S17  1  0.700  0.019  0.344  1.0
  S  S18  1  0.682  0.700  0.656  1.0
  S  S19  1  0.600  0.909  0.004  1.0
  S  S20  1  0.692  0.600  0.996  1.0
  N  N21  1  0.601  0.602  0.829  1.0
  N  N22  1  0.168  0.301  0.071  1.0
  N  N23  1  0.832  0.699  0.929  1.0
  N  N24  1  0.399  0.398  0.171  1.0
  N  N25  1  0.866  0.168  0.929  1.0
  N  N26  1  0.134  0.832  0.071  1.0
  N  N27  1  0.602  0.001  0.171  1.0
  N  N28  1  0.301  0.134  0.929  1.0
  N  N29  1  0.699  0.866  0.071  1.0
  N  N30  1  0.999  0.601  0.171  1.0
  N  N31  1  0.001  0.399  0.829  1.0
  N  N32  1  0.398  0.999  0.829  1.0
  O  O33  1  0.895  0.059  0.674  1.0
  O  O34  1  0.105  0.941  0.326  1.0
  O  O35  1  0.059  0.164  0.326  1.0
  O  O36  1  0.836  0.895  0.326  1.0
  O  O37  1  0.941  0.836  0.674  1.0
  O  O38  1  0.164  0.105  0.674  1.0
  F  F39  1  0.447  0.792  0.606  1.0
  F  F40  1  0.655  0.447  0.394  1.0
  F  F41  1  0.541  0.320  0.693  1.0
  F  F42  1  0.208  0.655  0.606  1.0
  F  F43  1  0.680  0.221  0.693  1.0
  F  F44  1  0.459  0.680  0.307  1.0
  F  F45  1  0.221  0.541  0.307  1.0
  F  F46  1  0.553  0.208  0.394  1.0
  F  F47  1  0.779  0.459  0.693  1.0
  F  F48  1  0.320  0.779  0.307  1.0
  F  F49  1  0.792  0.345  0.394  1.0
  F  F50  1  0.345  0.553  0.606  1.0
[/CIF]
.
The crystal structure described by ZnC6S12(N2O)6(AsF6)2 is Indium-derived structured and crystallizes in the trigonal P-3 space group. The structure is zero-dimensional and consists of two AsF6 clusters and one ZnC6S12(N2O)6 cluster. In each AsF6 cluster, As(1) is bonded in an octahedral geometry to three equivalent F(1) and three equivalent F(2) atoms. There are two inequivalent F sites. In the first F site, F(2) is bonded in a single-bond geometry to one As(1) atom. In the second F site, F(1) is bonded in a single-bond geometry to one As(1) atom. In the ZnC6S12(N2O)6 cluster, Zn(1) is bonded in an octahedral geometry to six equivalent O(1) atoms. C(1) is bonded in a distorted bent 120 degrees geometry to one N(2), one S(2), and one O(1) atom. There are two inequivalent N sites. In the first N site, N(1) is bonded in a water-like geometry to one S(1) and one S(2) atom. In the second N site, N(2) is bonded in a bent 120 degrees geometry to one C(1) and one S(1) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded in a water-like geometry to one N(1) and one N(2) atom. In the second S site, S(2) is bonded in a distorted water-like geometry to one C(1) and one N(1) atom. O(1) is bonded in a distorted bent 150 degrees geometry to one Zn(1) and one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_ZnAs2C6S12N12(OF2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.138
_cell_length_b   12.138
_cell_length_c   6.863
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   875.680
_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
  Zn  Zn0  1  0.000  0.000  0.500  1.0
  As  As1  1  0.667  0.333  0.543  1.0
  As  As2  1  0.333  0.667  0.457  1.0
  C  C3  1  0.243  0.083  0.757  1.0
  C  C4  1  0.757  0.917  0.243  1.0
  C  C5  1  0.160  0.243  0.243  1.0
  C  C6  1  0.083  0.840  0.243  1.0
  C  C7  1  0.917  0.160  0.757  1.0
  C  C8  1  0.840  0.757  0.757  1.0
  S  S9  1  0.308  0.400  0.004  1.0
  S  S10  1  0.400  0.091  0.996  1.0
  S  S11  1  0.300  0.981  0.656  1.0
  S  S12  1  0.318  0.300  0.344  1.0
  S  S13  1  0.091  0.692  0.004  1.0
  S  S14  1  0.981  0.682  0.344  1.0
  S  S15  1  0.019  0.318  0.656  1.0
  S  S16  1  0.909  0.308  0.996  1.0
  S  S17  1  0.700  0.019  0.344  1.0
  S  S18  1  0.682  0.700  0.656  1.0
  S  S19  1  0.600  0.909  0.004  1.0
  S  S20  1  0.692  0.600  0.996  1.0
  N  N21  1  0.601  0.602  0.829  1.0
  N  N22  1  0.168  0.301  0.071  1.0
  N  N23  1  0.832  0.699  0.929  1.0
  N  N24  1  0.399  0.398  0.171  1.0
  N  N25  1  0.866  0.168  0.929  1.0
  N  N26  1  0.134  0.832  0.071  1.0
  N  N27  1  0.602  0.001  0.171  1.0
  N  N28  1  0.301  0.134  0.929  1.0
  N  N29  1  0.699  0.866  0.071  1.0
  N  N30  1  0.999  0.601  0.171  1.0
  N  N31  1  0.001  0.399  0.829  1.0
  N  N32  1  0.398  0.999  0.829  1.0
  O  O33  1  0.895  0.059  0.674  1.0
  O  O34  1  0.105  0.941  0.326  1.0
  O  O35  1  0.059  0.164  0.326  1.0
  O  O36  1  0.836  0.895  0.326  1.0
  O  O37  1  0.941  0.836  0.674  1.0
  O  O38  1  0.164  0.105  0.674  1.0
  F  F39  1  0.447  0.792  0.606  1.0
  F  F40  1  0.655  0.447  0.394  1.0
  F  F41  1  0.541  0.320  0.693  1.0
  F  F42  1  0.208  0.655  0.606  1.0
  F  F43  1  0.680  0.221  0.693  1.0
  F  F44  1  0.459  0.680  0.307  1.0
  F  F45  1  0.221  0.541  0.307  1.0
  F  F46  1  0.553  0.208  0.394  1.0
  F  F47  1  0.779  0.459  0.693  1.0
  F  F48  1  0.320  0.779  0.307  1.0
  F  F49  1  0.792  0.345  0.394  1.0
  F  F50  1  0.345  0.553  0.606  1.0
[/CIF]
.