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	hartrees
Energy at 0K	-138.491729
Energy at 298.15K	-138.494759
HF Energy	-138.280991
Nuclear repulsion energy	36.514492

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	3094	2944	18.63	95.87	0.04	0.08
2	A₁	1590	1513	8.37	7.35	0.74	0.85
3	A₁	1067	1015	40.59	5.96	0.46	0.63
4	E	3162	3008	47.02	49.06	0.75	0.86
4	E	3162	3008	47.02	49.06	0.75	0.86
5	E	1610	1532	1.19	22.87	0.75	0.86
5	E	1610	1532	1.19	22.87	0.75	0.86
6	E	1214	1155	0.32	9.12	0.75	0.86
6	E	1214	1155	0.32	9.12	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		1.4280	1.0929	1.0929	1.0929
F2	1.4280		2.0719	2.0719	2.0719
H3	1.0929	2.0719		1.7805	1.7805
H4	1.0929	2.0719	1.7805		1.7805
H5	1.0929	2.0719	1.7805	1.7805

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	H3	109.843	F2	C1	H4	109.843
F2	C1	H5	109.843	H3	C1	H4	109.097
H3	C1	H5	109.097	H4	C1	H5	109.097

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

using model chemistry: MP2/3-21G*

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: MP2/3-21G*

States and conformations

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