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Compare vibrational frequencies in CCCBDB for HSO3F (Fluorosulfonic acid)

BLYP/6-31+G**

18 11 26 13 55
Frequency in cm-1
  Calculated   Experimental
Mode Number Symmetry Frequency Scaled
Frequency
Harm.
diff
Fund.
diff
Symmetry Harmonic
Frequency
Fundamental
Frequency
Comment
1 A 3589 3570   -32 A   3602  
2 A 1342 1335   -151 A   1486  
3 A 1118 1112   -131 A   1243  
4 A 1105 1099   -51 A   1150  
5 A 743 739   -157 A   896  
6 A 678 675   -148 A   823  
7 A 466 464   -98 A   562  
8 A 448 446   -105 A   551  
9 A 438 435   -83 A   518  
10 A 366 364   -45 A   409  
11 A 318 316   -74 A   390  
12 A 249 248   -18 A   266  
The calculated vibrational frequencies were scaled by 0.9947

See section Calculated; Vibrations; Scale Factors; Set scaling factors to change the scale factors used here.
See section Calculated; Vibrations; Scale Factors; Calculate a scale factor to determine the least squares best scaling factor.
See section Calculated; Vibrations; Scale Factors; Scale factor uncertainty for information on where the above scaling factor is from.