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	hartrees
Energy at 0K	-47.314086
Energy at 298.15K	-47.316466
HF Energy	-47.037019
Nuclear repulsion energy	16.264516

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2989	2989	65.15
2	A₁	1114	1114	1.22
3	A₁	638	638	35.08
4	E	3053	3053	54.16
4	E	3053	3053	54.17
5	E	1465	1465	4.87
5	E	1465	1465	4.87
6	E	442	442	166.87
6	E	442	442	166.88

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.587
C2	0.000	0.000	0.388
H3	0.000	1.009	0.811
H4	-0.874	-0.505	0.811
H5	0.874	-0.505	0.811

	Li1	C2	H3	H4	H5
Li1		1.9746	2.6019	2.6019	2.6019
C2	1.9746		1.0946	1.0946	1.0946
H3	2.6019	1.0946		1.7482	1.7482
H4	2.6019	1.0946	1.7482		1.7482
H5	2.6019	1.0946	1.7482	1.7482

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	C2	H3	112.767	Li1	C2	H4	112.767
Li1	C2	H5	112.767	H3	C2	H4	105.983
H3	C2	H5	105.983	H4	C2	H5	105.983

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

using model chemistry: CCSD=FULL/Def2TZVPP

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=FULL/Def2TZVPP

States and conformations

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