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	hartrees
Energy at 0K	-47.321536
Energy at 298.15K	-47.323866
HF Energy	-47.039400
Nuclear repulsion energy	16.317895

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2999	2999	62.41
2	A₁	1111	1111	0.00
3	A₁	638	638	36.43
4	E	3067	3067	54.82
4	E	3067	3067	54.83
5	E	1468	1468	4.39
5	E	1468	1468	4.39
6	E	413	413	163.54
6	E	413	413	163.55

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.576
C2	0.000	0.000	0.384
H3	0.000	1.008	0.808
H4	-0.873	-0.504	0.808
H5	0.873	-0.504	0.808

	Li1	C2	H3	H4	H5
Li1		1.9601	2.5880	2.5880	2.5880
C2	1.9601		1.0937	1.0937	1.0937
H3	2.5880	1.0937		1.7467	1.7467
H4	2.5880	1.0937	1.7467		1.7467
H5	2.5880	1.0937	1.7467	1.7467

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	C2	H3	112.771	Li1	C2	H4	112.771
Li1	C2	H5	112.771	H3	C2	H4	105.979
H3	C2	H5	105.979	H4	C2	H5	105.979

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

using model chemistry: CCSD=FULL/cc-pVQZ

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/cc-pVQZ

States and conformations

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