Accuracy

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137 18 Trifluoroiodomethane - formaldehyde

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###  |  |
# | Species | Formula
127 | 08 Trichloromethane - methane | C2H5Cl3 |
128 | 09 Fluoromethane dimer | C2H6F2 |
129 | 10 Chloromethane dimer | C2H6Cl2 |
130 | 11 Trifluorobenzene - benzene | C12H9F3 |
131 | 12 Hexafluorobenzene - benzene | C12H6F6 |
132 | 13 Chloromethane - formaldehyde | C2H5OCl |
133 | 14 Bromomethane - formaldehyde | C2H5OBr |
134 | 15 Iodomethane - formaldehyde | C2H5OI |
135 | 16 Trifluorochloromethane - formaldehyde | C2H2OF3Cl |
136 | 17 Trifluorobromomethane - formaldehyde | C2H2OF3Br |
137 | 18 Trifluoroiodomethane - formaldehyde | C2H2OF3I |
138 | 27 Bromomethane - benzene | C7H9Br |
139 | 28 Iodomethane - benzene | C7H9I |
140 | 29 Trifluorobromomethane - benzene | C7H6F3Br |
141 | 30 Trifluoroiodomethane - benzene | C7H6F3I |
142 | 31 Trifluoromethanol - water | CH3O2F3 |
143 | 32 Trichloromethanol - water | CH3O2Cl3 |
144 | 33 HF - methanol | CH5OF |
145 | 34 HCl - methanol | CH5OCl |
146 | 35 HBr - methanol | CH5OBr |
147 | 36 HI - methanol | CH5OI |

ΔHf: -4.1 kcal/mol, REF: P. Jurecka, J. Sponer, J. Cerny, P. Hobza, Phys. Chem. Chem. Phys. Lett. 8, 1985 (2006)

     0SCF HTML
    18 Trifluoroiodomethane - formaldehyde
     H=-4.136+"18 Trifluoroiodomethane - formaldehyde separated.mop" HR=CCSDT HWT=5
      C    -0.08221802 +0  -0.06155874 +0  -0.10680848 +0
      I     1.90122575 +1   0.39921262 +0   0.53218876 +0
      F    -0.25002231 +0  -1.37789572 +1  -0.21405756 +0
      F    -0.97788086 +0   0.40068629 +0   0.76171565 +0
      F    -0.33519735 +0   0.48538233 +0  -1.29378900 +0
      O     4.80925425 +0   0.83703065 +0   1.16946155 +0
      C     5.55654076 +0   0.23512987 +0   0.42797947 +0
      H     6.64808446 +0   0.29635707 +0   0.53669294 +0
      H     5.17706170 +0  -0.39898454 +0  -0.38651786 +0