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	hartrees
Energy at 0K	-1889.876299
Energy at 298.15K	-1889.875676
HF Energy	-1889.876299
Nuclear repulsion energy	420.934204

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1110	1097	0.00
2	A₁	395	390	0.00
3	A₁	170	168	0.00
4	B₁	24	24	0.00
5	B₂	710	702	146.99
6	B₂	285	282	3.88
7	E	887	877	285.35
7	E	887	877	285.35
8	E	474	469	5.50
8	E	474	469	5.50
9	E	94	93	0.62
9	E	94	93	0.62

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.843
B2	0.000	0.000	-0.843
Cl3	0.000	1.520	1.731
Cl4	0.000	-1.520	1.731
Cl5	1.520	0.000	-1.731
Cl6	-1.520	0.000	-1.731

	B1	B2	Cl3	Cl4	Cl5	Cl6
B1		1.6868	1.7604	1.7604	2.9896	2.9896
B2	1.6868		2.9896	2.9896	1.7604	1.7604
Cl3	1.7604	2.9896		3.0408	4.0750	4.0750
Cl4	1.7604	2.9896	3.0408		4.0750	4.0750
Cl5	2.9896	1.7604	4.0750	4.0750		3.0408
Cl6	2.9896	1.7604	4.0750	4.0750	3.0408

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	Cl5	120.271	B1	B2	Cl6	120.271
B2	B1	Cl3	120.271	B2	B1	Cl4	120.271
Cl3	B1	Cl4	119.458	Cl5	B2	Cl6	119.458

All results from a given calculation for B₂Cl₄ (Diboron tetrachloride)

using model chemistry: PBEPBE/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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Number	Element	Mulliken
1	B	0.048
2	B	0.048
3	Cl	-0.024
4	Cl	-0.024
5	Cl	-0.024
6	Cl	-0.024

<r²>	406.435
(<r²>)^1/2	20.160

All results from a given calculation for B2Cl4 (Diboron tetrachloride)

using model chemistry: PBEPBE/TZVP

States and conformations

All results from a given calculation for B₂Cl₄ (Diboron tetrachloride)