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	hartrees
Energy at 0K	-5225.723661
Energy at 298.15K	-5225.731327
HF Energy	-5225.723661
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3246	3105	0.57
2	A₁	1674	1601	33.04
3	A₁	1207	1154	1.95
4	A₁	601	575	8.34
5	A₁	110	105	0.03
6	A₂	929	889	0.00
7	A₂	390	373	0.00
8	B₁	698	668	74.14
9	B₂	3224	3083	16.35
10	B₂	1307	1250	43.72
11	B₂	779	745	71.38
12	B₂	484	463	2.18

Atom	y (Å)	z (Å)
C1	0.662	1.242
C2	-0.662	1.242
Br3	1.766	-0.275
Br4	-1.766	-0.275
H5	1.208	2.176
H6	-1.208	2.176

	C1	C2	Br3	Br4	H5	H6
C1		1.3233	1.8769	2.8630	1.0819	2.0896
C2	1.3233		2.8630	1.8769	2.0896	1.0819
Br3	1.8769	2.8630		3.5319	2.5144	3.8539
Br4	2.8630	1.8769	3.5319		3.8539	2.5144
H5	1.0819	2.0896	2.5144	3.8539		2.4152
H6	2.0896	1.0819	3.8539	2.5144	2.4152

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	126.041	C1	C2	H6	120.309
C2	C1	Br3	126.041	C2	C1	H5	120.309
Br3	C1	H5	113.649	Br4	C2	H6	113.649

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

using model chemistry: wB97X-D/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	-0.213
2	C	-0.213
3	Br	0.029
4	Br	0.029
5	H	0.184
6	H	0.184

	x	y	z	Total
	0.000	0.000	1.718	1.718
CHELPG
AIM
ESP

<r²>	289.124
(<r²>)^1/2	17.004