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	hartrees
Energy at 0K	-1890.645784
Energy at 298.15K	-1890.645241
HF Energy	-1890.645784
Nuclear repulsion energy	420.940894

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1132	1087	0.00
2	A₁	403	388	0.00
3	A₁	175	168	0.00
4	B₁	24	23	0.00
5	B₂	726	698	168.73
6	B₂	295	283	4.83
7	E	908	873	307.51
7	E	908	873	307.51
8	E	493	474	9.56
8	E	493	474	9.56
9	E	100	96	1.13
9	E	100	96	1.13

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	0.846
B2	0.000	0.000	-0.846
Cl3	0.000	1.519	1.732
Cl4	0.000	-1.519	1.732
Cl5	1.519	0.000	-1.732
Cl6	-1.519	0.000	-1.732

	B1	B2	Cl3	Cl4	Cl5	Cl6
B1		1.6928	1.7587	1.7587	2.9930	2.9930
B2	1.6928		2.9930	2.9930	1.7587	1.7587
Cl3	1.7587	2.9930		3.0384	4.0769	4.0769
Cl4	1.7587	2.9930	3.0384		4.0769	4.0769
Cl5	2.9930	1.7587	4.0769	4.0769		3.0384
Cl6	2.9930	1.7587	4.0769	4.0769	3.0384

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	Cl5	120.252	B1	B2	Cl6	120.252
B2	B1	Cl3	120.252	B2	B1	Cl4	120.252
Cl3	B1	Cl4	119.496	Cl5	B2	Cl6	119.496

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

using model chemistry: B3LYPultrafine/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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Number	Element	Mulliken
1	B	0.111
2	B	0.111
3	Cl	-0.056
4	Cl	-0.056
5	Cl	-0.056
6	Cl	-0.056

<r²>	406.760
(<r²>)^1/2	20.168

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

using model chemistry: B3LYPultrafine/6-31G**

States and conformations

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