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	hartrees
Energy at 0K	-5226.299313
Energy at 298.15K	-5226.306961
HF Energy	-5226.299313
Nuclear repulsion energy	429.820055

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3250	3115	1.72
2	A₁	1665	1596	35.66
3	A₁	1194	1145	1.47
4	A₁	603	578	8.71
5	A₁	115	110	0.02
6	A₂	903	866	0.00
7	A₂	385	369	0.00
8	B₁	690	661	77.42
9	B₂	3228	3094	13.42
10	B₂	1300	1246	42.11
11	B₂	778	746	73.10
12	B₂	485	465	2.00

Atom	y (Å)	z (Å)
C1	0.661	1.243
C2	-0.661	1.243
Br3	1.752	-0.275
Br4	-1.752	-0.275
H5	1.211	2.174
H6	-1.211	2.174

	C1	C2	Br3	Br4	H5	H6
C1		1.3227	1.8695	2.8511	1.0805	2.0905
C2	1.3227		2.8511	1.8695	2.0905	1.0805
Br3	1.8695	2.8511		3.5033	2.5081	3.8436
Br4	2.8511	1.8695	3.5033		3.8436	2.5081
H5	1.0805	2.0905	2.5081	3.8436		2.4213
H6	2.0905	1.0805	3.8436	2.5081	2.4213

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	125.678	C1	C2	H6	120.555
C2	C1	Br3	125.678	C2	C1	H5	120.555
Br3	C1	H5	113.768	Br4	C2	H6	113.768

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

using model chemistry: B1B95/6-311G*

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	-0.316
2	C	-0.316
3	Br	0.042
4	Br	0.042
5	H	0.274
6	H	0.274

	x	y	z	Total
	0.000	0.000	1.685	1.685
CHELPG
AIM
ESP

<r²>	285.522
(<r²>)^1/2	16.897