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	hartrees
Energy at 0K	-10362.500576
Energy at 298.15K
HF Energy	-10362.500576
Nuclear repulsion energy	1469.519863

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A_g	1699	1699	0.00	33.33	0.22	0.37
2	A_g	269	269	0.00	12.69	0.20	0.34
3	A_g	148	148	0.00	4.56	0.70	0.82
4	A_u	62	62	0.00	0.00	0.00	0.00
5	B_1u	632	632	28.06	0.00	0.00	0.00
6	B_1u	188	188	0.05	0.00	0.00	0.00
7	B_2g	568	568	0.00	2.65	0.75	0.86
8	B_2u	781	781	111.85	0.00	0.00	0.00
9	B_2u	124	124	0.39	0.00	0.00	0.00
10	B_3g	907	907	0.00	8.04	0.75	0.86
11	B_3g	221	221	0.00	4.41	0.75	0.86
12	B_3u	264	264	3.16	0.00	0.00	0.00

Atom	y (Å)	z (Å)
C1	0.000	0.665
C2	0.000	-0.665
Br3	1.603	1.691
Br4	-1.603	1.691
Br5	-1.603	-1.691
Br6	1.603	-1.691

	C1	C2	Br3	Br4	Br5	Br6
C1		1.3304	1.9036	1.9036	2.8503	2.8503
C2	1.3304		2.8503	2.8503	1.9036	1.9036
Br3	1.9036	2.8503		3.2066	4.6610	3.3828
Br4	1.9036	2.8503	3.2066		3.3828	4.6610
Br5	2.8503	1.9036	4.6610	3.3828		3.2066
Br6	2.8503	1.9036	3.3828	4.6610	3.2066

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br5	122.622	C1	C2	Br6	122.622
C2	C1	Br3	122.622	C2	C1	Br4	122.622
Br3	C1	Br4	114.757	Br5	C2	Br6	114.757

All results from a given calculation for C₂Br₄ (tetrabromoethene)

using model chemistry: wB97X-D/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	C	-0.496
2	C	-0.496
3	Br	0.248
4	Br	0.248
5	Br	0.248
6	Br	0.248

<r²>	817.117
(<r²>)^1/2	28.585

All results from a given calculation for C2Br4 (tetrabromoethene)

using model chemistry: wB97X-D/6-31G

States and conformations

All results from a given calculation for C₂Br₄ (tetrabromoethene)