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	hartrees
Energy at 0K	-34.631883
Energy at 298.15K	-34.635931
HF Energy	-34.456364
Nuclear repulsion energy	17.168268

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2586	2489
2	A₁	2247	2163
3	A₁	1236	1189
4	A₁	668	643
5	E	2215	2132
5	E	2215	2132
6	E	1269	1222
6	E	1269	1221
7	E	1113	1072
7	E	1113	1072
8	E	470	453
8	E	470	453

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.440
B2	0.000	0.000	0.512
H3	0.000	0.000	1.721
H4	0.000	1.159	0.013
H5	1.004	-0.579	0.013
H6	-1.004	-0.579	0.013

	Li1	B2	H3	H4	H5	H6
Li1		1.9522	3.1617	1.8591	1.8591	1.8591
B2	1.9522		1.2095	1.2614	1.2615	1.2615
H3	3.1617	1.2095		2.0639	2.0639	2.0639
H4	1.8591	1.2614	2.0639		2.0071	2.0071
H5	1.8591	1.2615	2.0639	2.0071		2.0071
H6	1.8591	1.2615	2.0639	2.0071	2.0071

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	B2	H3	180.000	Li1	B2	H4	66.724
Li1	B2	H5	66.724	Li1	B2	H6	66.724
Li1	H4	B2	74.718	Li1	H5	B2	74.718
Li1	H6	B2	74.718	H3	B2	H4	113.276
H3	B2	H5	113.276	H3	B2	H6	113.276
H4	B2	H5	105.413	H4	B2	H6	105.413
H5	B2	H6	105.413

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

using model chemistry: CCSD(T)/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 LiBH4 (Lithium borohydride)

using model chemistry: CCSD(T)/aug-cc-pVDZ

States and conformations

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