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	hartrees
Energy at 0K	-39.778045
Energy at 298.15K	-39.779231
HF Energy	-39.580533
Nuclear repulsion energy	9.747245

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'	3187	3048	0.00	163.26	0.05	0.09
2	A₂"	509	487	77.21	0.00	0.75	0.86
3	E'	3382	3234	1.34	24.46	0.75	0.86
3	E'	3382	3234	1.34	24.46	0.75	0.86
4	E'	1445	1382	2.42	0.78	0.75	0.86
4	E'	1445	1382	2.42	0.78	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.000	0.000
H2	0.000	1.071
H3	0.928	-0.536
H4	-0.928	-0.536

	C1	H2	H3	H4
C1		1.0713	1.0713	1.0713
H2	1.0713		1.8555	1.8555
H3	1.0713	1.8555		1.8555
H4	1.0713	1.8555	1.8555

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: MP2=FULL/aug-cc-pVQZ

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: MP2=FULL/aug-cc-pVQZ

States and conformations

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