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	hartrees
Energy at 0K	-47.250549
Energy at 298.15K	-47.246067
HF Energy	-47.015475
Nuclear repulsion energy	16.169162

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3096	3096	90.46
2	A₁	1258	1258	4.64
3	A₁	655	655	30.57
4	E	3152	3152	82.34
4	E	3152	3152	82.34
5	E	1598	1598	4.88
5	E	1598	1598	4.88
6	E	498	498	188.55
6	E	498	498	188.55

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.607
C2	0.000	0.000	0.394
H3	0.000	1.010	0.820
H4	-0.875	-0.505	0.820
H5	0.875	-0.505	0.820

	Li1	C2	H3	H4	H5
Li1		2.0008	2.6287	2.6287	2.6287
C2	2.0008		1.0962	1.0962	1.0962
H3	2.6287	1.0962		1.7494	1.7494
H4	2.6287	1.0962	1.7494		1.7494
H5	2.6287	1.0962	1.7494	1.7494

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	C2	H3	112.871	Li1	C2	H4	112.871
Li1	C2	H5	112.871	H3	C2	H4	105.867
H3	C2	H5	105.867	H4	C2	H5	105.867

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

using model chemistry: CBS-Q

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: CBS-Q

States and conformations

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