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	hartrees
Energy at 0K	-34.325147
Energy at 298.15K	-34.329126
HF Energy	-34.243786
Nuclear repulsion energy	17.030724

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2680	2550	110.30
2	A₁	2275	2165	161.97
3	A₁	1248	1187	133.56
4	A₁	656	624	167.70
5	E	2230	2121	372.81
5	E	2230	2121	372.81
6	E	1310	1246	15.89
6	E	1310	1246	15.89
7	E	1167	1110	27.93
7	E	1167	1110	27.93
8	E	431	410	0.15
8	E	431	410	0.15

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.485
B2	0.000	0.000	0.523
H3	0.000	0.000	1.722
H4	0.000	1.159	0.039
H5	1.004	-0.579	0.039
H6	-1.004	-0.579	0.039

	Li1	B2	H3	H4	H5	H6
Li1		2.0084	3.2070	1.9147	1.9147	1.9147
B2	2.0084		1.1986	1.2558	1.2558	1.2558
H3	3.2070	1.1986		2.0431	2.0431	2.0431
H4	1.9147	1.2558	2.0431		2.0071	2.0071
H5	1.9147	1.2558	2.0431	2.0071		2.0071
H6	1.9147	1.2558	2.0431	2.0071	2.0071

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	B2	H3	180.000	Li1	B2	H4	67.327
Li1	B2	H5	67.327	Li1	B2	H6	67.327
Li1	H4	B2	75.431	Li1	H5	B2	75.431
Li1	H6	B2	75.431	H3	B2	H4	112.673
H3	B2	H5	112.673	H3	B2	H6	112.673
H4	B2	H5	106.088	H4	B2	H6	106.088
H5	B2	H6	106.088

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

using model chemistry: MP2/3-21G*

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: MP2/3-21G*

States and conformations

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