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	hartrees
Energy at 0K	-137.239318
Energy at 298.15K	-137.242336
HF Energy	-137.167894
Nuclear repulsion energy	36.690712

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3313	2945	8.28	34.34	0.04	0.07
2	A₁	1678	1491	2.60	4.61	0.69	0.82
3	A₁	1256	1117	4.86	3.96	0.46	0.63
4	E	3480	3094	9.61	23.18	0.75	0.86
4	E	3480	3094	9.61	23.18	0.75	0.86
5	E	1715	1525	0.82	15.59	0.75	0.86
5	E	1715	1525	0.82	15.59	0.75	0.86
6	E	1255	1116	3.13	3.83	0.75	0.86
6	E	1255	1116	3.13	3.83	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.635
F2	0.000	0.000	0.767
H3	0.000	1.041	-1.032
H4	0.901	-0.520	-1.032
H5	-0.901	-0.520	-1.032

	C1	F2	H3	H4	H5
C1		1.4018	1.1140	1.1140	1.1140
F2	1.4018		2.0784	2.0784	2.0784
H3	1.1140	2.0784		1.8027	1.8027
H4	1.1140	2.0784	1.8027		1.8027
H5	1.1140	2.0784	1.8027	1.8027

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	H3	110.890	F2	C1	H4	110.890
F2	C1	H5	110.890	H3	C1	H4	108.016
H3	C1	H5	108.016	H4	C1	H5	108.016

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

using model chemistry: MP2=FULL/STO-3G

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: MP2=FULL/STO-3G

States and conformations

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