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	hartrees
Energy at 0K	-39.720537
Energy at 298.15K	-39.721715
HF Energy	-39.565520
Nuclear repulsion energy	9.569486

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3130	3019	0.00
2	A₂"	499	481	75.49
3	E'	3320	3202	4.84
3	E'	3320	3202	4.84
4	E'	1418	1367	1.32
4	E'	1418	1367	1.32

Atom	x (Å)	y (Å)
C1	0.000	0.000
H2	0.000	1.091
H3	0.945	-0.546
H4	-0.945	-0.546

	C1	H2	H3	H4
C1		1.0912	1.0912	1.0912
H2	1.0912		1.8899	1.8899
H3	1.0912	1.8899		1.8899
H4	1.0912	1.8899	1.8899

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	H3	120.000		H2	C1	H4	120.000
H3	C1	H4	120.000

All results from a given calculation for CH₃ (Methyl radical)

using model chemistry: CCD/aug-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 CH3 (Methyl radical)

using model chemistry: CCD/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₃ (Methyl radical)