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	hartrees
Energy at 0K	-34.598495
Energy at 298.15K	-34.602679
HF Energy	-34.453408
Nuclear repulsion energy	17.416756

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2720	2541	129.32
2	A₁	2347	2193	160.17
3	A₁	1296	1211	109.02
4	A₁	707	661	152.71
5	E	2336	2183	357.97
5	E	2336	2183	357.97
6	E	1341	1253	2.92
6	E	1341	1253	2.92
7	E	1185	1107	35.61
7	E	1185	1107	35.61
8	E	537	502	2.06
8	E	537	502	2.06

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.431
B2	0.000	0.000	0.503
H3	0.000	0.000	1.691
H4	0.000	1.142	0.029
H5	0.989	-0.571	0.029
H6	-0.989	-0.571	0.029

	Li1	B2	H3	H4	H5	H6
Li1		1.9348	3.1224	1.8534	1.8534	1.8534
B2	1.9348		1.1876	1.2367	1.2367	1.2367
H3	3.1224	1.1876		2.0169	2.0169	2.0169
H4	1.8534	1.2367	2.0169		1.9777	1.9777
H5	1.8534	1.2367	2.0169	1.9777		1.9777
H6	1.8534	1.2367	2.0169	1.9777	1.9777

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	B2	H3	180.000	Li1	B2	H4	67.413
Li1	B2	H5	67.413	Li1	B2	H6	67.413
Li1	H4	B2	74.556	Li1	H5	B2	74.556
Li1	H6	B2	74.556	H3	B2	H4	112.587
H3	B2	H5	112.587	H3	B2	H6	112.587
H4	B2	H5	106.184	H4	B2	H6	106.184
H5	B2	H6	106.184

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

using model chemistry: MP2=FULL/6-31G**

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=FULL/6-31G**

States and conformations

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