PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

zri6, dianion r   6239 Zirconium hexaiodide, dianion (Geo)

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    #  Species Formula
  6229 vanadium(V) pentaiodide (Geo)VI5
  6230 Aluminum triiodide (Al2I6) (Geo)Al2I6
  6231 Aluminum triiodide dimerAl2I6
  6232 Scandium(III) hexaiodide (Geo)ScI6
  6233 Titanium(IV) hexaiodide (Geo)TiI6
  6234 Vanadium(V) hexaiodide (Geo)VI6
  6235 Fe(III)I6 d5 (Geo)FeI6
  6236 Co(III)I6 d6 (Geo)CoI6
  6237 Yttrium(III) hexaiodide (Geo)YI6
  6238 Yttrium(III) hexaiodideYI6
  6239 Zirconium hexaiodide, dianion (Geo) ZrI6
  6240 Niobium(V) hexaiodide, anion (Geo)NbI6
  6241 Niobium(V) hexaiodideNbI6
  6242 Indium triiodide, dimerIn2I6
  6243 Indium triiodide, dimer (Geo)In2I6
  6244 SbI6(-)SbI6
  6245 SbI6(-) (Geo)SbI6
  6246 Te(IV)I6(2-) (CEMFEF10) (Geo)TeI6
  6247 Te(IV)I6(2-) (CEMFEF10)TeI6
  6248 Ti(IV)I4Cp (JOHJOF) (Geo)C6H6Al2TiI8
  6249 Ti(II)I4(Ar) (TEFCEM) (Geo)C9H12Al2TiI8


REF: Calculated using the HF 6-31G(d) basis set in Gaussian 03: M.J. Frisch, et. al., Gaussian 03, Gaussian Inc, Pittsburg, (2003).
  
 PULAY CHARGE=-2 SYMMETRY PM7
Zirconium hexaiodide, dianion
 <Zr-I> GR=HF631G
 Zr     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  I     2.94680000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  I     2.94680000 +0   90.0000000 +0    0.0000000 +0     1     2     0
  I     2.94680000 +1   90.0000000 +0   90.0000000 +0     1     2     3
  I     2.94680000 +0   90.0000000 +0  180.0000000 +0     1     2     3
  I     2.94680000 +1   90.0000000 +1  -90.0000000 +0     1     2     3
  I     2.94680000 +0  180.0000000 +0    0.0000000 +0     1     2     3