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	hartrees
Energy at 0K	-47.349460
Energy at 298.15K	-47.351840
HF Energy	-47.281409
Nuclear repulsion energy	16.240160

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2988	2988	76.13
2	A₁	1112	1112	7.58
3	A₁	630	630	22.91
4	E	3055	3055	54.08
4	E	3055	3055	53.90
5	E	1467	1467	4.32
5	E	1467	1467	4.35
6	E	443	443	180.41
6	E	443	443	180.68

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.584
C2	0.000	0.000	0.387
H3	0.000	1.014	0.809
H4	-0.878	-0.507	0.809
H5	0.878	-0.507	0.809

	Li1	C2	H3	H4	H5
Li1		1.9708	2.5986	2.5986	2.5986
C2	1.9708		1.0985	1.0985	1.0985
H3	2.5986	1.0985		1.7570	1.7570
H4	2.5986	1.0985	1.7570		1.7570
H5	2.5986	1.0985	1.7570	1.7570

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	C2	H3	112.572	Li1	C2	H4	112.572
Li1	C2	H5	112.572	H3	C2	H4	106.201
H3	C2	H5	106.201	H4	C2	H5	106.200

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

using model chemistry: B2PLYP=FULL/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: B2PLYP=FULL/6-311G**

States and conformations

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