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	hartrees
Energy at 0K	-47.180525
Energy at 298.15K	-47.182975
HF Energy	-47.015335
Nuclear repulsion energy	16.080923

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3001	2858	75.03
2	A₁	1160	1105	43.84
3	A₁	615	586	14.24
4	E	3078	2932	50.04
4	E	3078	2932	50.04
5	E	1515	1442	7.33
5	E	1515	1442	7.33
6	E	494	471	226.65
6	E	494	471	226.65

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.613
C2	0.000	0.000	0.400
H3	0.000	1.021	0.814
H4	-0.885	-0.511	0.814
H5	0.885	-0.511	0.814

	Li1	C2	H3	H4	H5
Li1		2.0131	2.6332	2.6332	2.6332
C2	2.0131		1.1020	1.1020	1.1020
H3	2.6332	1.1020		1.7691	1.7691
H4	2.6332	1.1020	1.7691		1.7691
H5	2.6332	1.1020	1.7691	1.7691

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	C2	H3	112.058	Li1	C2	H4	112.058
Li1	C2	H5	112.058	H3	C2	H4	106.765
H3	C2	H5	106.765	H4	C2	H5	106.765

All results from a given calculation for CH₃Li (methyl lithium)

using model chemistry: QCISD/6-31G*

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 CH3Li (methyl lithium)

using model chemistry: QCISD/6-31G*

States and conformations

All results from a given calculation for CH₃Li (methyl lithium)