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	hartrees
Energy at 0K	-5224.681861
Energy at 298.15K	-5224.689466
HF Energy	-5224.508311
Nuclear repulsion energy	425.586313

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3244	3244	1.91
2	A₁	1629	1629	32.58
3	A₁	1206	1206	1.69
4	A₁	586	586	8.30
5	A₁	109	109	0.02
6	A₂	888	888	0.00
7	A₂	377	377	0.00
8	B₁	687	687	76.01
9	B₂	3222	3222	13.43
10	B₂	1310	1310	44.63
11	B₂	768	768	70.29
12	B₂	476	476	2.51

Atom	y (Å)	z (Å)
C1	0.665	1.248
C2	-0.665	1.248
Br3	1.774	-0.276
Br4	-1.774	-0.276
H5	1.212	2.181
H6	-1.212	2.181

	C1	C2	Br3	Br4	H5	H6
C1		1.3299	1.8850	2.8762	1.0817	2.0963
C2	1.3299		2.8762	1.8850	2.0963	1.0817
Br3	1.8850	2.8762		3.5483	2.5205	3.8673
Br4	2.8762	1.8850	3.5483		3.8673	2.5205
H5	1.0817	2.0963	2.5205	3.8673		2.4246
H6	2.0963	1.0817	3.8673	2.5205	2.4246

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	126.046	C1	C2	H6	120.397
C2	C1	Br3	126.046	C2	C1	H5	120.397
Br3	C1	H5	113.557	Br4	C2	H6	113.557

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

using model chemistry: B2PLYP/6-311G*

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	-0.301
2	C	-0.301
3	Br	0.035
4	Br	0.035
5	H	0.266
6	H	0.266

	x	y	z	Total
	0.000	0.000	1.727	1.727
CHELPG
AIM
ESP

<r²>	291.713
(<r²>)^1/2	17.080