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	hartrees
Energy at 0K	-139.347490
Energy at 298.15K	-139.350525
HF Energy	-139.033914
Nuclear repulsion energy	37.242904

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3108	2917	23.76
2	A₁	1554	1458	7.35
3	A₁	1125	1056	88.53
4	E	3199	3002	40.52
4	E	3199	3002	40.52
5	E	1560	1464	1.70
5	E	1560	1464	1.70
6	E	1226	1151	1.04
6	E	1226	1151	1.04

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.634
F2	0.000	0.000	0.753
H3	0.000	1.033	-0.991
H4	0.895	-0.516	-0.991
H5	-0.895	-0.516	-0.991

	C1	F2	H3	H4	H5
C1		1.3876	1.0929	1.0929	1.0929
F2	1.3876		2.0275	2.0275	2.0275
H3	1.0929	2.0275		1.7892	1.7892
H4	1.0929	2.0275	1.7892		1.7892
H5	1.0929	2.0275	1.7892	1.7892

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	H3	109.067	F2	C1	H4	109.067
F2	C1	H5	109.067	H3	C1	H4	109.872
H3	C1	H5	109.872	H4	C1	H5	109.872

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

using model chemistry: MP3/6-31G*

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: MP3/6-31G*

States and conformations

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