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	hartrees
Energy at 0K	-139.223607
Energy at 298.15K	-139.226615
HF Energy	-138.992782
Nuclear repulsion energy	36.190389

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3052	2928	17.02
2	A₁	1517	1456	4.48
3	A₁	1016	975	52.69
4	E	3145	3017	38.08
4	E	3145	3017	38.08
5	E	1547	1484	2.63
5	E	1547	1484	2.63
6	E	1165	1118	0.62
6	E	1165	1118	0.62

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.666
F2	0.000	0.000	0.781
H3	0.000	1.042	-1.011
H4	0.903	-0.521	-1.011
H5	-0.903	-0.521	-1.011

	C1	F2	H3	H4	H5
C1		1.4476	1.0976	1.0976	1.0976
F2	1.4476		2.0730	2.0730	2.0730
H3	1.0976	2.0730		1.8050	1.8050
H4	1.0976	2.0730	1.8050		1.8050
H5	1.0976	2.0730	1.8050	1.8050

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	H3	108.292	F2	C1	H4	108.292
F2	C1	H5	108.292	H3	C1	H4	110.624
H3	C1	H5	110.624	H4	C1	H5	110.624

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

using model chemistry: CCD/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: CCD/6-31G

States and conformations

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