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	hartrees
Energy at 0K	-5200.012906
Energy at 298.15K	-5200.020581
HF Energy	-5199.864168
Nuclear repulsion energy	430.874385

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3262	3262	0.83
2	A₁	1628	1628	27.66
3	A₁	1228	1228	1.49
4	A₁	607	607	8.75
5	A₁	113	113	0.01
6	A₂	943	943	0.00
7	A₂	392	392	0.00
8	B₁	718	718	74.10
9	B₂	3237	3237	12.02
10	B₂	1348	1348	33.97
11	B₂	782	782	53.09
12	B₂	482	482	2.22

Atom	y (Å)	z (Å)
C1	0.665	1.284
C2	-0.665	1.284
Br3	1.724	-0.283
Br4	-1.724	-0.283
H5	1.235	2.203
H6	-1.235	2.203

	C1	C2	Br3	Br4	H5	H6
C1		1.3308	1.8916	2.8578	1.0809	2.1107
C2	1.3308		2.8578	1.8916	2.1107	1.0809
Br3	1.8916	2.8578		3.4483	2.5339	3.8648
Br4	2.8578	1.8916	3.4483		3.8648	2.5339
H5	1.0809	2.1107	2.5339	3.8648		2.4697
H6	2.1107	1.0809	3.8648	2.5339	2.4697

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	124.036	C1	C2	H6	121.792
C2	C1	Br3	124.036	C2	C1	H5	121.792
Br3	C1	H5	114.172	Br4	C2	H6	114.172

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

using model chemistry: B2PLYP/3-21G*

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	-0.235
2	C	-0.235
3	Br	-0.011
4	Br	-0.011
5	H	0.246
6	H	0.246

	x	y	z	Total
	0.000	0.000	1.615	1.615
CHELPG
AIM
ESP

<r²>	280.509
(<r²>)^1/2	16.748