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

-Te-S-(CH2)3-   5767 -Te-S-(CH2)3-

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    #  Species Formula
  5757 Te(VI)F7(-) (ROLSOA)F7Te
  5758 Te(IV)C2F2 (VEJWUC) (Geo)C2F8Te
  5759 Te(IV)C2F2 (VEJWUC)C2F8Te
  5760 Al-Te, complex (Geo)AlTe
  5761 Aluminum tellurideAlTe
  5762 TeH-AlH2, complex (Geo)H3AlTe
  5763 TeF2.PF3 (Geo)F5PTe
  5764 TeF3.PF3(+) (Geo)F6PTe
  5765 Me-Te-S-Me (Geo)C2H6STe
  5766 Me-Te-S-MeC2H6STe
  5767 -Te-S-(CH2)3- C3H6STe
  5768 -Te-S-(CH2)3- (Geo)C3H6STe
  5769 TeS2S2Te
  5770 TeS2 (Geo)S2Te
  5771 Te(SH)2H2S2Te
  5772 Te(SH)2 (Geo)H2S2Te
  5773 Te(II)S2 (RACNEP) (Geo)C2H6S2Te
  5774 Te(II)S2 (RACNEP)C2H6S2Te
  5775 MeOPh-Te-S-P(S)(OMe)2 (Geo)C9H13O3PS2Te
  5776 Te(II)S4 (TEMXAN10) (Geo)C4H6O2S4Te
  5777 Te(II)S4 (TEMXAN10)C4H6O2S4Te


ΔHf: -1.8 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
-Te-S-(CH2)3-
 H=-1.8 HR=PW91D
 Te     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  S     2.41627745 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     2.15926373 +1   87.6301183 +1    0.0000000 +0     1     2     0
  C     1.52413722 +1  108.7726756 +1  -18.2583669 +1     3     1     2
  C     1.52630366 +1  113.1271861 +1   46.3783957 +1     4     3     1
  H     1.09490224 +1  107.6669653 +1 -121.8156325 +1     3     1     4
  H     1.09589087 +1  107.1457115 +1 -116.5621053 +1     3     1     6
  H     1.11215568 +1  110.1694695 +1 -124.0368678 +1     4     3     5
  H     1.11234673 +1  108.9935124 +1 -114.2664505 +1     4     3     8
  H     1.10621981 +1  110.9814082 +1 -175.5955612 +1     5     4     3
  H     1.10563277 +1  111.1148566 +1 -118.7154763 +1     5     4    10