PM7 Accuracy

dipropyl sulfite   2176 Dipropyl sulfite

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    #  Species Formula
  2166 CysteineC3H7NO2S
  2167 MethionineC5H11NO2S
  2168 Sulfur trioxide (Geo)O3S
  2169 Sulfur trioxideO3S
  2170 HOSO2(-)HO3S
  2171 H2SO3H2O3S
  2172 Dimethyl sulfiteC2H6O3S
  2173 Dimethyl sulfite (Geo)C2H6O3S
  2174 (CH3O)(C2H5O)SOC3H8O3S
  2175 Diethyl sulfiteC4H10O3S
  2176 Dipropyl sulfite C6H14O3S
  2177 Di-n-butyl sulfiteC8H18O3S
  2178 Li(I)O3N (FOBHEJ) (Geo)H18LiC10NO3S
  2179 Li(I)O3N (FOBHEJ)H18LiC10NO3S
  2180 Sulfuric acid (Geo)H2O4S
  2181 Sulfuric acidH2O4S
  2182 Lithium sulfate anionLiO4S
  2183 Lithium sulfateLi2O4S
  2184 Dimethyl sulfateC2H6O4S
  2185 Dimethyl sulfate (Geo)C2H6O4S
  2186 (CH3O)3SOC3H9O4S


DHf: -140.5 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 PM7
Dipropyl sulfite
 H=-140.5 HR=NIST
  O    -0.02078921  1  -0.01099388  1   0.08686301  1
  S     1.48619665  1   0.66917667  1   0.19596156  1
  O     1.08436720  1   2.23837500  1   0.56712726  1
  C    -0.88214926  1   0.08557119  1  -1.02307368  1
  C     0.88136974  1   3.26701745  1  -0.37104676  1
  O     2.01655939  1   0.70232314  1  -1.16836738  1
  C    -2.02400516  1   1.03972155  1  -0.65657501  1
  C     2.22023655  1   3.77188385  1  -0.91768576  1
  C    -3.00474780  1   1.16347625  1  -1.81780492  1
  C     2.02320493  1   5.10472210  1  -1.63479849  1
  H    -1.24396764  1  -0.95321295  1  -1.16174290  1
  H    -0.34117963  1   0.40022112  1  -1.93385678  1
  H     0.36553643  1   4.03825798  1   0.23765745  1
  H     0.21016220  1   2.92541076  1  -1.17856873  1
  H    -1.62216252  1   2.03117198  1  -0.37447734  1
  H    -2.53625632  1   0.66931697  1   0.25308652  1
  H     2.65771103  1   3.02237451  1  -1.61007960  1
  H     2.94831739  1   3.87829455  1  -0.09133646  1
  H    -3.82139128  1   1.85228858  1  -1.57106837  1
  H    -3.46121258  1   0.19816308  1  -2.06747917  1
  H    -2.51792672  1   1.54466656  1  -2.72289857  1
  H     2.96574022  1   5.46173878  1  -2.06721369  1
  H     1.66329187  1   5.88238338  1  -0.95198647  1
  H     1.30194035  1   5.01816889  1  -2.45584065  1