Left: sections of the experimental spectra showing the c-type transition 53,3–42,3 of Phe–H2O (a), Phe–H218O (b), and Phe–D2O (c) and the c-type transition 51,4–40,4 of Phe–HDO
(d). Right: sections of the experimental spectra showing the a-type transition 515–414 of
Phe–H2O (a), Phe–H218O (b), and Phe–D2O (c) and the a-type transition 53,3–43,2 of Phe–HDO
(d). Red dashed lines connect the two tunneling states generated by C2 internal rotation of the water molecule, while
the blue arrows connect the two tunneling states arising from water’s
translation motion. The two transitions are labeled following the
notation JKa,Kc ← JK′a,K′c′. For each component of
the tunneling splitting, the lower and upper tunneling states are
indicated as 0+, 0–, 1+, and
1–. The magnitude of the splittings is given in
megahertz.