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	hartrees
Energy at 0K	-138.495192
Energy at 298.15K	-138.498224
HF Energy	-138.281006
Nuclear repulsion energy	36.519911

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	3095	2955	18.60	95.80	0.04	0.08
2	A₁	1590	1519	8.34	7.35	0.74	0.85
3	A₁	1067	1019	40.57	5.95	0.46	0.63
4	E	3163	3020	46.87	49.02	0.75	0.86
4	E	3163	3020	46.87	49.02	0.75	0.86
5	E	1610	1537	1.21	22.87	0.75	0.86
5	E	1610	1537	1.21	22.87	0.75	0.86
6	E	1215	1160	0.32	9.11	0.75	0.86
6	E	1215	1160	0.32	9.11	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.652
F2	0.000	0.000	0.776
H3	0.000	1.028	-1.023
H4	0.890	-0.514	-1.023
H5	-0.890	-0.514	-1.023

	C1	F2	H3	H4	H5
C1		1.4277	1.0927	1.0927	1.0927
F2	1.4277		2.0717	2.0717	2.0717
H3	1.0927	2.0717		1.7803	1.7803
H4	1.0927	2.0717	1.7803		1.7803
H5	1.0927	2.0717	1.7803	1.7803

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	H3	109.847	F2	C1	H4	109.847
F2	C1	H5	109.847	H3	C1	H4	109.092
H3	C1	H5	109.092	H4	C1	H5	109.093

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

using model chemistry: MP2=FULL/3-21G

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/3-21G

States and conformations

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