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The PA subset - Results for XYG3

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) and root mean square (RMSD) deviations are shown.
The results were published in: Goerigk, L.; Grimme, S. J. Chem. Theory Comput. 2011, 7, 291-309.

XYG3
# Result Res. - Ref.
1 168.15 0.3531
2 196.22 2.8222
3 213.68 3.9797
4 224.72 5.0166
5 211.95 0.0496
6 171.69 0.0897
7 156.60 -0.8044
8 156.03 -0.7730
9 194.42 1.7188
10 174.24 0.0413
11 137.41 -0.3947
12 105.18 -1.1215
MD 0.91
MAD 1.43
RMSD 2.14