Accuracy

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144 33 HF - methanol

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###  |  |
# | Species | Formula
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 |
148 | 37 HF - methylamine | CH6NF |
149 | 38 HCl - methylamine | CH6NCl |
150 | 39 methanol - fluoromethane | C2H7OF |
151 | 40 methanol - chloromethane | C2H7OCl |
152 | acetate ... methanol | C3H7O3 |
153 | acetate ... methylamine | C3H8NO2 |
154 | acetate ... water | C2H5O3 |

ΔHf: -9.7 kcal/mol, REF: P. Jurecka, J. Sponer, J. Cerny, P. Hobza, Phys. Chem. Chem. Phys. Lett. 8, 1985 (2006)

     0SCF HTML
    33 HF - methanol
     H=-9.739+"33 HF - methanol separated.mop" HR=CCSDT HWT=1
      F     0.32473823 +0  -0.00009617 +0   0.36751324 +0
      H     0.10635660 +1  -0.00001561 +0   1.27453560 +0
      O    -0.16723559 +0   0.00014556 +1   2.94306433 +0
      H    -1.01096915 +0  -0.00003988 +0   3.39903315 +0
      C     0.88199533 +0   0.00001882 +0   3.90679154 +0
      H     1.81338532 +0   0.00005984 +0   3.35106626 +0
      H     0.84952570 +0   0.88916881 +0   4.53461649 +0
      H     0.84949511 +0  -0.88926104 +0   4.53443081 +0