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	hartrees
Energy at 0K	-139.585949
Energy at 298.15K	-139.588988
HF Energy	-139.097740
Nuclear repulsion energy	37.569604

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3105	3105	29.85
2	A₁	1527	1527	1.52
3	A₁	1119	1119	108.19
4	E	3177	3177	24.76
4	E	3177	3177	24.76
5	E	1545	1545	5.18
5	E	1545	1545	5.18
6	E	1231	1231	1.76
6	E	1231	1231	1.76

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.629
F2	0.000	0.000	0.746
H3	0.000	1.027	-0.980
H4	0.889	-0.513	-0.980
H5	-0.889	-0.513	-0.980

	C1	F2	H3	H4	H5
C1		1.3749	1.0850	1.0850	1.0850
F2	1.3749		2.0083	2.0083	2.0083
H3	1.0850	2.0083		1.7781	1.7781
H4	1.0850	2.0083	1.7781		1.7781
H5	1.0850	2.0083	1.7781	1.7781

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	H3	108.885	F2	C1	H4	108.885
F2	C1	H5	108.885	H3	C1	H4	110.051
H3	C1	H5	110.051	H4	C1	H5	110.051

All results from a given calculation for CH₃F (Methyl fluoride)

using model chemistry: MP3=FULL/aug-cc-pVTZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CH3F (Methyl fluoride)

using model chemistry: MP3=FULL/aug-cc-pVTZ

States and conformations

All results from a given calculation for CH₃F (Methyl fluoride)