Accuracy

Bi(III)I6(3-) (KOQCAU) r   8238 Bi(III)I6(3-) (KOQCAU) (Geo)

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    #  Species Formula
  8228 Bi(III)Br6(3-) (DEJLUZ) (Geo)Br6Bi
  8229 Bi(III)Br6(3-) (DEJLUZ)Br6Bi
  8230 Bi(III)Cl2I2(-) (JAJFEG) (Geo)Cl2I2Bi
  8231 Bi(III)Cl2I2(-) (JAJFEG)Cl2I2Bi
  8232 Bismuth triiodide (Geo)I3Bi
  8233 Bismuth triiodideI3Bi
  8234 Bi(III)N3I3 (BIMCUV) (Geo)C15H15N3I3Bi
  8235 Bi(III)N3I3 (BIMCUV)C15H15N3I3Bi
  8236 Bi(III)I4(-) (PICIBI) (Geo)I4Bi
  8237 Bi(III)I4(-) (PICIBI)I4Bi
  8238 Bi(III)I6(3-) (KOQCAU) (Geo) I6Bi
  8239 Bi(III)I6(3-) (KOQCAU)I6Bi
  8240 Bismuth, dimerBi2
  8241 Bi2F4F4Bi2
  8242 Bi2F4 (Geo)F4Bi2
  8243 Bi2F6F6Bi2
  8244 Bi2F6 (Geo)F6Bi2
  8245 Bi2Cl4Cl4Bi2
  8246 Bi2Cl4 (Geo)Cl4Bi2
  8247 Bi2Cl6Cl6Bi2
  8248 Bi2Cl6 (Geo)Cl6Bi2


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 CHARGE=-3 PM7
Bi(III)I6(3-) (KOQCAU)
 <Bi-I> GR=CCDC
 Bi     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  I     3.08715200 +1    0.0000000 +0    0.0000000 +0     1     0     0
  I     3.13090916 +1   90.2339630 +1    0.0000000 +0     1     2     0
  I     3.13106775 +1   90.0610082 +1   90.0184311 +1     1     2     3
  I     3.13163229 +1   90.1795338 +1  179.9647922 +1     1     4     2
  I     3.13059198 +1   90.1832288 +1  179.9347923 +1     1     2     3
  I     3.13151585 +1   90.0683037 +1   89.9402536 +1     1     2     6