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	hartrees
Energy at 0K	-5219.738743
Energy at 298.15K	-5219.746351
HF Energy	-5219.577464
Nuclear repulsion energy	429.326493

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3275	3109	0.83
2	A₁	1648	1565	29.20
3	A₁	1197	1136	1.97
4	A₁	588	558	9.88
5	A₁	116	110	0.03
6	A₂	898	852	0.00
7	A₂	379	359	0.00
8	B₁	703	667	59.54
9	B₂	3255	3089	13.23
10	B₂	1306	1239	42.49
11	B₂	765	726	58.00
12	B₂	473	449	3.71

Atom	y (Å)	z (Å)
C1	0.666	1.270
C2	-0.666	1.270
Br3	1.741	-0.280
Br4	-1.741	-0.280
H5	1.225	2.196
H6	-1.225	2.196

	C1	C2	Br3	Br4	H5	H6
C1		1.3315	1.8862	2.8623	1.0823	2.1058
C2	1.3315		2.8623	1.8862	2.1058	1.0823
Br3	1.8862	2.8623		3.4813	2.5293	3.8639
Br4	2.8623	1.8862	3.4813		3.8639	2.5293
H5	1.0823	2.1058	2.5293	3.8639		2.4508
H6	2.1058	1.0823	3.8639	2.5293	2.4508

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	124.743	C1	C2	H6	121.138
C2	C1	Br3	124.743	C2	C1	H5	121.138
Br3	C1	H5	114.120	Br4	C2	H6	114.120

All results from a given calculation for CHBrCHBr (Ethene, 1,2-dibromo-, (Z)-)

using model chemistry: B2PLYP/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	-0.145
2	C	-0.145
3	Br	-0.063
4	Br	-0.063
5	H	0.209
6	H	0.209

	x	y	z	Total
	0.000	0.000	1.794	1.794
CHELPG
AIM
ESP

<r²>	284.057
(<r²>)^1/2	16.854