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	hartrees
Energy at 0K	-47.227414
Energy at 298.15K	-47.229791
HF Energy	-47.031620
Nuclear repulsion energy	16.156450

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2981	2981	80.28
2	A₁	1134	1134	6.74
3	A₁	626	626	27.66
4	E	3049	3049	65.71
4	E	3049	3049	65.72
5	E	1472	1472	4.88
5	E	1472	1472	4.88
6	E	441	441	176.04
6	E	441	441	176.04

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.596
C2	0.000	0.000	0.390
H3	0.000	1.017	0.816
H4	-0.881	-0.508	0.816
H5	0.881	-0.508	0.816

	Li1	C2	H3	H4	H5
Li1		1.9853	2.6176	2.6176	2.6176
C2	1.9853		1.1027	1.1027	1.1027
H3	2.6176	1.1027		1.7612	1.7612
H4	2.6176	1.1027	1.7612		1.7612
H5	2.6176	1.1027	1.7612	1.7612

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	C2	H3	112.763	Li1	C2	H4	112.763
Li1	C2	H5	112.763	H3	C2	H4	105.988
H3	C2	H5	105.988	H4	C2	H5	105.988

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

using model chemistry: CCSD/6-311G**

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: CCSD/6-311G**

States and conformations

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