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	hartrees
Energy at 0K	-47.282175
Energy at 298.15K	-47.284518
HF Energy	-47.037032
Nuclear repulsion energy	16.331150

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3045	3045	54.50
2	A₁	1084	1084	0.04
3	A₁	643	643	37.04
4	E	3097	3097	40.15
4	E	3097	3097	40.15
5	E	1460	1460	4.61
5	E	1460	1460	4.61
6	E	424	424	161.91
6	E	424	424	161.91

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.575
C2	0.000	0.000	0.385
H3	0.000	1.009	0.804
H4	-0.874	-0.504	0.804
H5	0.874	-0.504	0.804

	Li1	C2	H3	H4	H5
Li1		1.9605	2.5842	2.5842	2.5842
C2	1.9605		1.0922	1.0922	1.0922
H3	2.5842	1.0922		1.7473	1.7473
H4	2.5842	1.0922	1.7473		1.7473
H5	2.5842	1.0922	1.7473	1.7473

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	C2	H3	112.536	Li1	C2	H4	112.536
Li1	C2	H5	112.536	H3	C2	H4	106.240
H3	C2	H5	106.240	H4	C2	H5	106.240

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

using model chemistry: MP2=FULL/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: MP2=FULL/daug-cc-pVTZ

States and conformations

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