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	hartrees
Energy at 0K	-487.327134
Energy at 298.15K	-487.333882
HF Energy	-487.210092
Nuclear repulsion energy	75.368448

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1885	1768	0.00
2	A_g	1468	1377	0.00
3	A_g	709	665	0.00
4	A_g	365	342	0.00
5	A_u	425	399	0.00
6	B_1g	1904	1786	0.00
7	B_1g	463	434	0.00
8	B_1u	1183	1110	451.68
9	B_1u	619	581	244.94
10	B_2g	1297	1217	0.00
11	B_2g	431	404	0.00
12	B_2u	1910	1792	406.60
13	B_2u	892	836	366.89
14	B_2u	238	223	8.10
15	B_3g	778	729	0.00
16	B_3u	1875	1759	127.65
17	B_3u	1415	1327	1446.57
18	B_3u	663	622	727.57

Atom	x (Å)	y (Å)	z (Å)
Al1	1.362	0.000	0.000
Al2	-1.362	0.000	0.000
H3	0.000	0.000	1.162
H4	0.000	0.000	-1.162
H5	2.046	1.453	0.000
H6	2.046	-1.453	0.000
H7	-2.046	1.453	0.000
H8	-2.046	-1.453	0.000

	Al1	Al2	H3	H4	H5	H6	H7	H8
Al1		2.7231	1.7899	1.7899	1.6061	1.6061	3.7045	3.7045
Al2	2.7231		1.7899	1.7899	3.7045	3.7045	1.6061	1.6061
H3	1.7899	1.7899		2.3237	2.7654	2.7654	2.7654	2.7654
H4	1.7899	1.7899	2.3237		2.7654	2.7654	2.7654	2.7654
H5	1.6061	3.7045	2.7654	2.7654		2.9058	4.0923	5.0190
H6	1.6061	3.7045	2.7654	2.7654	2.9058		5.0190	4.0923
H7	3.7045	1.6061	2.7654	2.7654	4.0923	5.0190		2.9058
H8	3.7045	1.6061	2.7654	2.7654	5.0190	4.0923	2.9058

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	Al2	H3	40.474	Al1	Al2	H4	40.474
Al1	Al2	H7	115.229	Al1	Al2	H8	115.229
Al1	H3	Al2	99.052	Al1	H4	Al2	99.052
Al2	Al1	H3	40.474	Al2	Al1	H4	40.474
Al2	Al1	H5	115.229	Al2	Al1	H6	115.229
H3	Al1	H4	80.948	H3	Al1	H5	108.919
H3	Al1	H6	108.919	H3	Al2	H4	80.948
H3	Al2	H7	108.919	H3	Al2	H8	108.919
H4	Al1	H5	108.919	H4	Al1	H6	108.919
H4	Al2	H7	108.919	H4	Al2	H8	108.919
H5	Al1	H6	129.542	H7	Al2	H8	129.542

All results from a given calculation for Al₂H₆ (dialane)

using model chemistry: CISD/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: CISD/6-31G

States and conformations

All results from a given calculation for Al₂H₆ (dialane)