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	hartrees
Energy at 0K	-47.220449
Energy at 298.15K	-47.222772
HF Energy	-47.023120
Nuclear repulsion energy	15.988409

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2961	2853	84.16
2	A₁	1098	1058	4.02
3	A₁	599	577	32.27
4	E	3033	2922	63.10
4	E	3033	2922	63.10
5	E	1435	1382	5.61
5	E	1435	1382	5.61
6	E	422	406	159.96
6	E	422	406	159.97

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.617
C2	0.000	0.000	0.396
H3	0.000	1.025	0.826
H4	-0.888	-0.513	0.826
H5	0.888	-0.513	0.826

	Li1	C2	H3	H4	H5
Li1		2.0131	2.6502	2.6502	2.6502
C2	2.0131		1.1120	1.1120	1.1120
H3	2.6502	1.1120		1.7757	1.7757
H4	2.6502	1.1120	1.7757		1.7757
H5	2.6502	1.1120	1.7757	1.7757

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	C2	H3	112.793	Li1	C2	H4	112.793
Li1	C2	H5	112.793	H3	C2	H4	105.955
H3	C2	H5	105.955	H4	C2	H5	105.955

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

using model chemistry: CCSD/aug-cc-pVDZ

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/aug-cc-pVDZ

States and conformations

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