Fig. 8
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Radial (1) and angular (2), (3), and (4) energy of interaction diagrams (Eint) belonging to the R30 and R33 entrance channels. Eint = Molecular energy of intermediate (E2) - molecular energy of reagents (E1). Molecular energies (E2 and E1) calculated atCCSD(T)-F12/cc-pVTZ-F12, units in kcal mol−1, angles in sexagesimal degrees, and molecular distances in Å.
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