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	hartrees
Energy at 0K	-487.456044
Energy at 298.15K	-487.462964
HF Energy	-487.310627
Nuclear repulsion energy	77.859194

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1993	1852	0.00
2	A_g	1570	1459	0.00
3	A_g	762	708	0.00
4	A_g	384	357	0.00
5	A_u	433	402	0.00
6	B_1g	2003	1861	0.00
7	B_1g	479	445	0.00
8	B_1u	1324	1230	386.83
9	B_1u	646	601	277.53
10	B_2g	1452	1349	0.00
11	B_2g	494	459	0.00
12	B_2u	2010	1867	405.78
13	B_2u	893	829	285.55
14	B_2u	223	208	13.50
15	B_3g	786	730	0.00
16	B_3u	1986	1845	110.90
17	B_3u	1542	1433	1222.89
18	B_3u	718	668	666.84

Atom	x (Å)	y (Å)	z (Å)
Al1	1.305	0.000	0.000
Al2	-1.305	0.000	0.000
H3	0.000	0.000	1.146
H4	0.000	0.000	-1.146
H5	1.995	1.419	0.000
H6	1.995	-1.419	0.000
H7	-1.995	1.419	0.000
H8	-1.995	-1.419	0.000

	Al1	Al2	H3	H4	H5	H6	H7	H8
Al1		2.6096	1.7367	1.7367	1.5783	1.5783	3.5923	3.5923
Al2	2.6096		1.7367	1.7367	3.5923	3.5923	1.5783	1.5783
H3	1.7367	1.7367		2.2923	2.7035	2.7035	2.7035	2.7035
H4	1.7367	1.7367	2.2923		2.7035	2.7035	2.7035	2.7035
H5	1.5783	3.5923	2.7035	2.7035		2.8386	3.9905	4.8971
H6	1.5783	3.5923	2.7035	2.7035	2.8386		4.8971	3.9905
H7	3.5923	1.5783	2.7035	2.7035	3.9905	4.8971		2.8386
H8	3.5923	1.5783	2.7035	2.7035	4.8971	3.9905	2.8386

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	Al2	H3	41.296	Al1	Al2	H4	41.296
Al1	Al2	H7	115.941	Al1	Al2	H8	115.941
Al1	H3	Al2	97.408	Al1	H4	Al2	97.408
Al2	Al1	H3	41.296	Al2	Al1	H4	41.296
Al2	Al1	H5	115.941	Al2	Al1	H6	115.941
H3	Al1	H4	82.592	H3	Al1	H5	109.187
H3	Al1	H6	109.187	H3	Al2	H4	82.592
H3	Al2	H7	109.187	H3	Al2	H8	109.187
H4	Al1	H5	109.187	H4	Al1	H6	109.187
H4	Al2	H7	109.187	H4	Al2	H8	109.187
H5	Al1	H6	128.118	H7	Al2	H8	128.118

All results from a given calculation for Al₂H₆ (dialane)

using model chemistry: CID/6-311G*

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 Al2H6 (dialane)

using model chemistry: CID/6-311G*

States and conformations

All results from a given calculation for Al₂H₆ (dialane)