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	hartrees
Energy at 0K	-1890.801621
Energy at 298.15K	-1890.801043
HF Energy	-1890.801621
Nuclear repulsion energy	423.798328

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1139	1091	0.00
2	A₁	405	388	0.00
3	A₁	170	162	0.00
4	B₁	22	21	0.00
5	B₂	731	700	163.06
6	B₂	287	275	5.96
7	E	925	886	293.92
7	E	925	886	293.92
8	E	487	466	7.26
8	E	487	466	7.26
9	E	93	89	0.75
9	E	93	89	0.75

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.843
B2	0.000	0.000	-0.843
Cl3	0.000	1.506	1.725
Cl4	0.000	-1.506	1.725
Cl5	1.506	0.000	-1.725
Cl6	-1.506	0.000	-1.725

	B1	B2	Cl3	Cl4	Cl5	Cl6
B1		1.6868	1.7451	1.7451	2.9772	2.9772
B2	1.6868		2.9772	2.9772	1.7451	1.7451
Cl3	1.7451	2.9772		3.0123	4.0542	4.0542
Cl4	1.7451	2.9772	3.0123		4.0542	4.0542
Cl5	2.9772	1.7451	4.0542	4.0542		3.0123
Cl6	2.9772	1.7451	4.0542	4.0542	3.0123

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	Cl5	120.336	B1	B2	Cl6	120.336
B2	B1	Cl3	120.336	B2	B1	Cl4	120.336
Cl3	B1	Cl4	119.328	Cl5	B2	Cl6	119.328

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

using model chemistry: B1B95/6-31G(2df,p)

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	0.289
2	B	0.289
3	Cl	-0.145
4	Cl	-0.145
5	Cl	-0.145
6	Cl	-0.145

<r²>	401.503
(<r²>)^1/2	20.038

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

using model chemistry: B1B95/6-31G(2df,p)

States and conformations

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