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	hartrees
Energy at 0K	-34.342073
Energy at 298.15K	-34.346032
HF Energy	-34.243694
Nuclear repulsion energy	16.986940

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2637	2464	104.52
2	A₁	2237	2091	151.97
3	A₁	1230	1150	125.70
4	A₁	654	611	168.99
5	E	2188	2044	355.45
5	E	2188	2044	355.45
6	E	1289	1204	15.99
6	E	1289	1204	15.99
7	E	1148	1073	25.53
7	E	1148	1073	25.54
8	E	425	398	0.20
8	E	425	398	0.20

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.487
B2	0.000	0.000	0.524
H3	0.000	0.000	1.726
H4	0.000	1.163	0.039
H5	1.007	-0.582	0.039
H6	-1.007	-0.582	0.039

	Li1	B2	H3	H4	H5	H6
Li1		2.0105	3.2131	1.9184	1.9184	1.9184
B2	2.0105		1.2026	1.2601	1.2601	1.2601
H3	3.2131	1.2026		2.0494	2.0494	2.0494
H4	1.9184	1.2601	2.0494		2.0144	2.0144
H5	1.9184	1.2601	2.0494	2.0144		2.0144
H6	1.9184	1.2601	2.0494	2.0144	2.0144

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	B2	H3	180.000	Li1	B2	H4	67.369
Li1	B2	H5	67.369	Li1	B2	H6	67.369
Li1	H4	B2	75.312	Li1	H5	B2	75.312
Li1	H6	B2	75.312	H3	B2	H4	112.631
H3	B2	H5	112.631	H3	B2	H6	112.631
H4	B2	H5	106.135	H4	B2	H6	106.135
H5	B2	H6	106.135

All results from a given calculation for LiBH₄ (Lithium borohydride)

using model chemistry: CISD/3-21G*

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 LiBH4 (Lithium borohydride)

using model chemistry: CISD/3-21G*

States and conformations

All results from a given calculation for LiBH₄ (Lithium borohydride)