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	hartrees
Energy at 0K	-487.391735
Energy at 298.15K	-487.398635
HF Energy	-487.274885
Nuclear repulsion energy	77.628204

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	2011	1896	0.00
2	A_g	1572	1482	0.00
3	A_g	769	725	0.00
4	A_g	382	361	0.00
5	A_u	433	408	0.00
6	B_1g	2024	1908	0.00
7	B_1g	479	452	0.00
8	B_1u	1336	1260	409.03
9	B_1u	650	613	264.32
10	B_2g	1448	1365	0.00
11	B_2g	498	469	0.00
12	B_2u	2030	1914	448.72
13	B_2u	888	838	282.68
14	B_2u	218	205	12.41
15	B_3g	792	747	0.00
16	B_3u	2003	1889	135.58
17	B_3u	1540	1452	1269.37
18	B_3u	724	683	651.39

Atom	x (Å)	y (Å)	z (Å)
Al1	1.313	0.000	0.000
Al2	-1.313	0.000	0.000
H3	0.000	0.000	1.151
H4	0.000	0.000	-1.151
H5	2.008	1.421	0.000
H6	2.008	-1.421	0.000
H7	-2.008	1.421	0.000
H8	-2.008	-1.421	0.000

	Al1	Al2	H3	H4	H5	H6	H7	H8
Al1		2.6251	1.7459	1.7459	1.5819	1.5819	3.6118	3.6118
Al2	2.6251		1.7459	1.7459	3.6118	3.6118	1.5819	1.5819
H3	1.7459	1.7459		2.3024	2.7160	2.7160	2.7160	2.7160
H4	1.7459	1.7459	2.3024		2.7160	2.7160	2.7160	2.7160
H5	1.5819	3.6118	2.7160	2.7160		2.8417	4.0161	4.9198
H6	1.5819	3.6118	2.7160	2.7160	2.8417		4.9198	4.0161
H7	3.6118	1.5819	2.7160	2.7160	4.0161	4.9198		2.8417
H8	3.6118	1.5819	2.7160	2.7160	4.9198	4.0161	2.8417

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	Al2	H3	41.253	Al1	Al2	H4	41.253
Al1	Al2	H7	116.082	Al1	Al2	H8	116.082
Al1	H3	Al2	97.493	Al1	H4	Al2	97.493
Al2	Al1	H3	41.253	Al2	Al1	H4	41.253
Al2	Al1	H5	116.082	Al2	Al1	H6	116.082
H3	Al1	H4	82.507	H3	Al1	H5	109.301
H3	Al1	H6	109.301	H3	Al2	H4	82.507
H3	Al2	H7	109.301	H3	Al2	H8	109.301
H4	Al1	H5	109.301	H4	Al1	H6	109.301
H4	Al2	H7	109.301	H4	Al2	H8	109.301
H5	Al1	H6	127.836	H7	Al2	H8	127.836

All results from a given calculation for Al₂H₆ (dialane)

using model chemistry: MP2/6-31G*

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 Al2H6 (dialane)

using model chemistry: MP2/6-31G*

States and conformations

All results from a given calculation for Al₂H₆ (dialane)