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The S22 subset - Results for M06HF

All results were obtained with the def2-QZVP basis set.
For each data point of the subset, the actual result in Eh and the
deviation from the reference value (Res. - Ref.; in kcal/mol) are given.
At the end of the table, mean (MD), mean absolute (MAD), root mean square (RMSD),
The results were published in: Goerigk, L.; Grimme, S. Phys. Chem. Chem. Phys. 2011, DOI: 10.1039/C0CP02984J.

M06HF M06HF-D3
# Result Res. - Ref. Result Res. - Ref.
1 2.58 -0.5864 2.69 -0.4803
2 5.28 0.2624 5.35 0.3301
3 21.14 2.3417 21.29 2.4883
4 16.18 0.0579 16.43 0.3094
5 21.00 0.3075 21.59 0.9032
6 15.71 -1.2893 16.42 -0.5780
7 15.15 -1.5904 15.93 -0.8105
8 0.77 0.2444 0.93 0.4008
9 1.04 -0.4567 1.23 -0.2661
10 1.27 -0.1791 1.73 0.2778
11 2.97 0.3455 4.06 1.4351
12 3.55 -0.6506 4.43 0.2296
13 10.46 0.7248 11.80 2.0613
14 4.45 -0.1363 5.89 1.3038
15 12.15 0.4905 13.97 2.3104
16 1.36 -0.1470 1.53 0.0173
17 4.20 0.9096 4.52 1.2255
18 2.18 -0.1442 2.59 0.2709
19 5.85 1.2976 6.18 1.6279
20 2.20 -0.5136 2.99 0.2785
21 5.41 -0.2111 6.41 0.7930
22 6.34 -0.7505 7.16 0.0673
MD 0.01 0.65
MAD 0.62 0.84
RMSD 0.83 1.11