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	hartrees
Energy at 0K	-139.411963
Energy at 298.15K	-139.414987
HF Energy	-139.044266
Nuclear repulsion energy	37.140182

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3050	2938
2	A₁	1497	1442
3	A₁	1092	1052
4	E	3142	3027
4	E	3142	3026
5	E	1492	1437
5	E	1491	1436
6	E	1198	1154
6	E	1198	1154

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.631
F2	0.000	0.000	0.754
H3	0.000	1.041	-1.000
H4	0.902	-0.521	-1.000
H5	-0.902	-0.521	-1.000

	C1	F2	H3	H4	H5
C1		1.3848	1.1049	1.1049	1.1049
F2	1.3848		2.0398	2.0398	2.0398
H3	1.1049	2.0398		1.8036	1.8036
H4	1.1049	2.0398	1.8036		1.8036
H5	1.1049	2.0398	1.8036	1.8036

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	H3	109.525	F2	C1	H4	109.525
F2	C1	H5	109.525	H3	C1	H4	109.418
H3	C1	H5	109.418	H4	C1	H5	109.418

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

using model chemistry: CCSD(T)=FULL/cc-pVDZ

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: CCSD(T)=FULL/cc-pVDZ

States and conformations

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