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	hartrees
Energy at 0K	-3242.293468
Energy at 298.15K	-3242.294214
HF Energy	-3241.361737
Nuclear repulsion energy	1150.293178

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	544	517	0.00
2	A_g	359	341	0.00
3	A_g	230	219	0.00
4	A_g	98	93	0.00
5	A_u	70	66	0.00
6	B_1g	643	611	0.00
7	B_1g	125	119	0.00
8	B_1u	449	427	170.51
9	B_1u	139	132	14.50
10	B_2g	304	289	0.00
11	B_2g	176	167	0.00
12	B_2u	654	621	367.40
13	B_2u	186	177	10.14
14	B_2u	21	20	0.72
15	B_3g	127	121	0.00
16	B_3u	504	479	398.09
17	B_3u	337	320	74.33
18	B_3u	141	134	23.16

Atom	x (Å)	y (Å)	z (Å)
Al1	1.596	0.000	0.000
Al2	-1.596	0.000	0.000
Cl3	0.000	0.000	1.613
Cl4	0.000	0.000	-1.613
Cl5	2.602	1.814	0.000
Cl6	2.602	-1.814	0.000
Cl7	-2.602	1.814	0.000
Cl8	-2.602	-1.814	0.000

	Al1	Al2	Cl3	Cl4	Cl5	Cl6	Cl7	Cl8
Al1		3.1919	2.2687	2.2687	2.0744	2.0744	4.5730	4.5730
Al2	3.1919		2.2687	2.2687	4.5730	4.5730	2.0744	2.0744
Cl3	2.2687	2.2687		3.2250	3.5582	3.5582	3.5582	3.5582
Cl4	2.2687	2.2687	3.2250		3.5582	3.5582	3.5582	3.5582
Cl5	2.0744	4.5730	3.5582	3.5582		3.6285	5.2036	6.3438
Cl6	2.0744	4.5730	3.5582	3.5582	3.6285		6.3438	5.2036
Cl7	4.5730	2.0744	3.5582	3.5582	5.2036	6.3438		3.6285
Cl8	4.5730	2.0744	3.5582	3.5582	6.3438	5.2036	3.6285

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	Cl3	Al2	89.408	Al1	Cl4	Al2	89.408
Cl3	Al1	Cl4	90.592	Cl3	Al1	Cl5	109.943
Cl3	Al1	Cl6	109.943	Cl3	Al2	Cl4	90.592
Cl3	Al2	Cl7	109.943	Cl3	Al2	Cl8	109.943
Cl4	Al1	Cl5	109.943	Cl4	Al1	Cl6	109.943
Cl4	Al2	Cl7	109.943	Cl4	Al2	Cl8	109.943
Cl5	Al1	Cl6	121.991	Cl7	Al2	Cl8	121.991

All results from a given calculation for Al₂Cl₆ (Aluminum, di-μ-chlorotetrachlorodi-)

using model chemistry: MP2/6-311G*

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 Al2Cl6 (Aluminum, di-μ-chlorotetrachlorodi-)

using model chemistry: MP2/6-311G*

States and conformations

All results from a given calculation for Al₂Cl₆ (Aluminum, di-μ-chlorotetrachlorodi-)