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. 2011 May 31;134(20):204115. doi: 10.1063/1.3593390

Figure 1.

Figure 1

Testing systems used in this work: acetaldehyde (left) and cyclopropanone (right). Index 1 is used for oxygen atom in both molecules; indexes 2, 3, and 4 are for carbon atoms in cyclopropanone; in acetaldehyde, indexes 2 and 4 are for carbon atoms, while index 3 is for hydrogen atom.