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	hartrees
Energy at 0K	-3242.411594
Energy at 298.15K	-3242.412236
HF Energy	-3241.370886
Nuclear repulsion energy	1139.606710

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_g	535	515
2	A_g	348	335
3	A_g	225	217
4	A_g	96	93
5	A_u	67	65
6	B_1g	627	604
7	B_1g	122	117
8	B_1u	443	427
9	B_1u	135	130
10	B_2g	297	286
11	B_2g	171	165
12	B_2u	637	613
13	B_2u	181	174
14	B_2u	16	15
15	B_3g	122	118
16	B_3u	494	475
17	B_3u	329	317
18	B_3u	141	136

Atom	x (Å)	y (Å)	z (Å)
Al1	1.592	0.000	0.000
Al2	-1.592	0.000	0.000
Cl3	0.000	0.000	1.628
Cl4	0.000	0.000	-1.628
Cl5	2.601	1.829	0.000
Cl6	2.601	-1.829	0.000
Cl7	-2.601	1.829	0.000
Cl8	-2.601	-1.829	0.000

	Al1	Al2	Cl3	Cl4	Cl5	Cl6	Cl7	Cl8
Al1		3.1833	2.2767	2.2767	2.0894	2.0894	4.5746	4.5746
Al2	3.1833		2.2767	2.2767	4.5746	4.5746	2.0894	2.0894
Cl3	2.2767	2.2767		3.2559	3.5725	3.5725	3.5725	3.5725
Cl4	2.2767	2.2767	3.2559		3.5725	3.5725	3.5725	3.5725
Cl5	2.0894	4.5746	3.5725	3.5725		3.6586	5.2025	6.3602
Cl6	2.0894	4.5746	3.5725	3.5725	3.6586		6.3602	5.2025
Cl7	4.5746	2.0894	3.5725	3.5725	5.2025	6.3602		3.6586
Cl8	4.5746	2.0894	3.5725	3.5725	6.3602	5.2025	3.6586

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	Cl3	Al2	88.709	Al1	Cl4	Al2	88.709
Cl3	Al1	Cl4	91.291	Cl3	Al1	Cl5	109.743
Cl3	Al1	Cl6	109.743	Cl3	Al2	Cl4	91.291
Cl3	Al2	Cl7	109.743	Cl3	Al2	Cl8	109.743
Cl4	Al1	Cl5	109.743	Cl4	Al1	Cl6	109.743
Cl4	Al2	Cl7	109.743	Cl4	Al2	Cl8	109.743
Cl5	Al1	Cl6	122.212	Cl7	Al2	Cl8	122.212

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

using model chemistry: MP4/TZVP

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: MP4/TZVP

States and conformations

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