## IV.C.1. (XIII.D.1.) |

Calculated | Experimental | |||||
---|---|---|---|---|---|---|

Mode Number | Symmetry | Frequency | diff | Symmetry | Frequency | Comment |

1 | A_{1} |
330 | -94 |
A_{1} |
424 | |

2 | E | 120 | -30 | E | 150 | |

3 | T_{2} |
515 | -106 |
T_{2} |
621 | |

4 | T_{2} |
177 | -44 |
T_{2} |
221 |

See section **XIII.C.3** List or set vibrational scaling factors to change the scale factors used here.

See section **III.B.3.c** Calculate a vibrational scaling factor for a set of molecules to determine the least squares best scaling factor.

See section **III.B.3.b** List of vibrational scaling factors and their uncertainties for information on where the above scaling factor is from.