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Table A.1.

Benchmark between FITWAT and ASFIT in fitting data for chlorobenzene.

Molecular parameters Units MHz × FITWAT a ASFIT b
A 5672.2931(133) 5672.2932(133)
B 1576.786974(380) 1576.786976(381)
C 1233.674849(278) 1233.674849(278)
ΔJ 10−05 6.02946(184) 6.02946(184)
ΔJK 10−04 2.81972(111) 2.81973(111)
ΔK 10−04 9.046(309) 9.047(309)
δJ 10−05 1.44719(104) 1.44720(104)
δK 10−04 3.07111(687) 3.07112(688)
Nc 186 186
Jmax ..... 105 105
Kmax ..... 46 46
νmax 261303.45 261303.45
σ 0.067 0.067
σw ..... 0.355 0.355

Notes. Numbers in parentheses represent the derived uncertainty (1σ) of the parameter in units of the last digit.

(a)

Rotational and centrifugal distortion constants obtained by FITWAT in the fit to the lines of chlorobenzene reported by Kisiel (1990).

(b)

Rotational and centrifugal distortion constants obtained by ASFIT in the fit to the lines of chlorobenzene reported by Kisiel (1990).

(c)

Number of fitted lines (each doublet counts as one single line).

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