Accuracy

36 HI - methanol    155 36 HI - methanol

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    #  Species Formula
   145 26 Iodobenzenezene - methanethiolC7H9SI
   146 27 Bromomethane - benzeneC7H9Br
   147 28 Iodomethane - benzeneC7H9I
   148 29 Trifluorobromomethane - benzeneC7H6F3Br
   149 30 Trifluoroiodomethane - benzeneC7H6F3I
   150 31 Trifluoromethanol - waterCH3O2F3
   151 32 Trichloromethanol - waterCH3O2Cl3
   152 33 HF - methanolCH5OF
   153 34 HCl - methanolCH5OCl
   154 35 HBr - methanolCH5OBr
   155 36 HI - methanol CH5OI
   156 37 HF - methylamineCH6NF
   157 38 HCl - methylamineCH6NCl
   158 39 methanol - fluoromethaneC2H7OF
   159 40 methanol - chloromethaneC2H7OCl
   160 acetate ... methanolC3H7O3
   161 acetate ... methylamineC3H8NO2
   162 acetate ... waterC2H5O3
   163 guanidinium ... formaldehydeC2H8N3O
   164 guanidinium ... methanolC2H10N3O
   165 guanidinium ... methylamineC2H11N4


ΔHf: -4.1 kcal/mol,     REF: P. Jurecka, J. Sponer, J. Cerny, P. Hobza, Phys. Chem. Chem. Phys. Lett. 8, 1985 (2006)
  
 0SCF HTML
36 HI - methanol
 H=-4.114+"36 HI - methanol separated.mop" HR=CCSDT HWT=5
  I     0.49436076 +0   0.00013673 +0  -0.29918615 +0
  H    -0.02681845 +1   0.00000982 +0   1.22777972 +0
  O    -0.30402627 +0  -0.00020991 +1   3.24054165 +0
  H    -1.06167171 +0   0.00003413 +0   3.83019664 +0
  C     0.87760517 +0  -0.00002964 +0   4.03349751 +0
  H     1.71561556 +0  -0.00013105 +0   3.34328351 +0
  H     0.94684111 +0   0.88889343 +0   4.66026337 +0
  H     0.94688809 +0  -0.88872339 +0   4.66058358 +0