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	hartrees
Energy at 0K	-47.263843
Energy at 298.15K	-47.266194
HF Energy	-47.037026
Nuclear repulsion energy	16.196965

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2977	2977	71.50
2	A₁	1107	1107	0.21
3	A₁	628	628	36.90
4	E	3042	3042	57.62
4	E	3042	3042	57.62
5	E	1466	1466	4.67
5	E	1466	1466	4.67
6	E	431	431	157.16
6	E	431	431	157.17

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.595
C2	0.000	0.000	0.390
H3	0.000	1.013	0.815
H4	-0.877	-0.507	0.815
H5	0.877	-0.507	0.815

	Li1	C2	H3	H4	H5
Li1		1.9850	2.6138	2.6138	2.6138
C2	1.9850		1.0984	1.0984	1.0984
H3	2.6138	1.0984		1.7547	1.7547
H4	2.6138	1.0984	1.7547		1.7547
H5	2.6138	1.0984	1.7547	1.7547

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	C2	H3	112.735	Li1	C2	H4	112.735
Li1	C2	H5	112.735	H3	C2	H4	106.020
H3	C2	H5	106.020	H4	C2	H5	106.020

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

using model chemistry: CCSD/daug-cc-pVTZ

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/daug-cc-pVTZ

States and conformations

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