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	hartrees
Energy at 0K	-39.549639
Energy at 298.15K	-39.550801
HF Energy	-39.524125
Nuclear repulsion energy	9.672920

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'	3155	3004	0.00	95.17	0.11	0.19
2	A₂"	477	454	103.70	0.00	0.75	0.86
3	E'	3334	3174	7.46	29.20	0.75	0.86
3	E'	3334	3174	7.46	29.20	0.75	0.86
4	E'	1480	1409	3.01	4.84	0.75	0.86
4	E'	1480	1409	3.01	4.84	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.000	0.000
H2	0.000	1.079
H3	0.935	-0.540
H4	-0.935	-0.540

	C1	H2	H3	H4
C1		1.0795	1.0795	1.0795
H2	1.0795		1.8697	1.8697
H3	1.0795	1.8697		1.8697
H4	1.0795	1.8697	1.8697

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: B2PLYP=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 CH3 (Methyl radical)

using model chemistry: B2PLYP=FULL/3-21G

States and conformations

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