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	hartrees
Energy at 0K	-10372.887911
Energy at 298.15K
HF Energy	-10372.887911
Nuclear repulsion energy	1479.300215

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	1632	1555	0.00	68.73	0.29	0.45
2	A_g	278	265	0.00	10.47	0.16	0.27
3	A_g	151	144	0.00	3.22	0.66	0.79
4	A_u	58	55	0.00	0.00	0.00	0.00
5	B_1u	656	625	32.38	0.00	0.00	0.00
6	B_1u	194	185	0.16	0.00	0.00	0.00
7	B_2g	501	477	0.00	1.32	0.75	0.86
8	B_2u	798	761	115.77	0.00	0.00	0.00
9	B_2u	123	118	0.18	0.00	0.00	0.00
10	B_3g	928	884	0.00	0.56	0.75	0.86
11	B_3g	219	208	0.00	2.97	0.75	0.86
12	B_3u	255	243	2.65	0.00	0.00	0.00

Atom	y (Å)	z (Å)
C1	0.000	0.672
C2	0.000	-0.672
Br3	1.583	1.691
Br4	-1.583	1.691
Br5	-1.583	-1.691
Br6	1.583	-1.691

	C1	C2	Br3	Br4	Br5	Br6
C1		1.3445	1.8824	1.8824	2.8445	2.8445
C2	1.3445		2.8445	2.8445	1.8824	1.8824
Br3	1.8824	2.8445		3.1656	4.6326	3.3823
Br4	1.8824	2.8445	3.1656		3.3823	4.6326
Br5	2.8445	1.8824	4.6326	3.3823		3.1656
Br6	2.8445	1.8824	3.3823	4.6326	3.1656

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br5	122.770	C1	C2	Br6	122.770
C2	C1	Br3	122.770	C2	C1	Br4	122.770
Br3	C1	Br4	114.459	Br5	C2	Br6	114.459

All results from a given calculation for C₂Br₄ (tetrabromoethene)

using model chemistry: wB97X-D/cc-pVDZ

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	-0.157
2	C	-0.157
3	Br	0.079
4	Br	0.079
5	Br	0.079
6	Br	0.079

<r²>	807.184
(<r²>)^1/2	28.411

All results from a given calculation for C2Br4 (tetrabromoethene)

using model chemistry: wB97X-D/cc-pVDZ

States and conformations

All results from a given calculation for C₂Br₄ (tetrabromoethene)