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

pb(ii)s3 (gigbih)   8158 Pb(II)S3 (GIGBIH)

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    #  Species Formula
  8148 18-Crown-6-diiodo-lead(II) (TOJPIR) (Geo)C12H24O6I2Pb
  8149 Pb(II)O6I2 (TOJPIR) (Geo)C12H24O6I2Pb
  8150 Pb(II)O6I2 (TOJPIR)C12H24O6I2Pb
  8151 Pb(IV)I6(2-) (FOLLIB) (Geo)I6Pb
  8152 Pb(IV)I6(2-) (FOLLIB)I6Pb
  8153 Lead, dimerPb2
  8154 HexamethyldiplumbaneC6H18Pb2
  8155 Hexamethyldiplumbane (Geo)C6H18Pb2
  8156 Pb(II)(Cp)F2 (VALVOT) (Geo)C20H30B2F8Pb2
  8157 Pb(II)S3 (GIGBIH) (Geo)C8N4S4Pb2
  8158 Pb(II)S3 (GIGBIH) C8N4S4Pb2
  8159 bis(mu-2-iodo)-tetrakis(iodo)-di-lead (GOGNEV) (Geo)I6Pb2
  8160 Bismuth, dicationBi
  8161 Bismuth, cationBi
  8162 Bismuth, atomBi
  8163 Bismuth trihydride (Geo)H3Bi
  8164 Bismuth trihydrideH3Bi
  8165 Lithium bismuthideLiBi
  8166 Trimethylbismuth (Geo)C3H9Bi
  8167 TrimethylbismuthC3H9Bi
  8168 C5H5Bi (Bismin)C5H5Bi


ΔHf: 217.2 kcal/mol,     REF: Estimated from DGauss results of DFT calculations, using the B88-PW91 functional and the DZVP basis set, in CAChe 6.0, Fujitsu Ltd, 2003.
  
 PM7
Pb(II)S3 (GIGBIH)
 H=217.2 HR=PW91D
 Pb     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  S     2.80128892 +1    0.0000000 +0    0.0000000 +0     1     0     0
  S     2.65180187 +1   93.7471420 +1    0.0000000 +0     1     2     0
  S     2.91215716 +1   79.0642812 +1  -63.1177463 +1     1     2     3
  C     2.73174659 +1   92.6040732 +1  175.2235544 +1     2     1     3
  C     1.41871595 +1   88.1087884 +1   73.9439573 +1     5     2     1
  C     1.41859726 +1  156.3514333 +1  178.3704753 +1     5     2     6
  N     1.15771157 +1  115.5434485 +1  178.7803623 +1     6     2     5
  N     1.15715215 +1  165.0591376 +1  179.7652326 +1     7     2     5
 Pb     2.90365157 +1  100.9232715 +1 -111.4874831 +1     2     1     5
  C     1.74051607 +1   94.2514780 +1  -74.2154343 +1     3     1     2
  S     2.65565577 +1   64.5518129 +1   98.9120930 +1    10     2     1
  C     1.35586457 +1  122.7196617 +1  176.6021118 +1    11     3     1
  C     1.41859876 +1  121.7883376 +1 -177.4036978 +1    13    11     3
  C     1.41851493 +1  122.5946859 +1  179.8148071 +1    13    11    14
  N     1.15791011 +1  151.1489463 +1 -176.5635595 +1    14    11    13
  N     1.15722975 +1  152.4500961 +1 -179.5094773 +1    15    11    13
  C     1.35575304 +1   33.6692667 +1    2.7460178 +1     5     2     7