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	hartrees
Energy at 0K	-5225.695475
Energy at 298.15K	-5225.703063
HF Energy	-5225.695475
Nuclear repulsion energy	424.020071

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3217	3109	2.12
2	A₁	1634	1579	36.92
3	A₁	1196	1156	1.98
4	A₁	574	555	8.92
5	A₁	107	104	0.02
6	A₂	892	862	0.00
7	A₂	381	368	0.00
8	B₁	683	660	76.09
9	B₂	3195	3088	12.36
10	B₂	1296	1253	47.53
11	B₂	756	731	75.77
12	B₂	472	456	3.23

Atom	y (Å)	z (Å)
C1	0.663	1.248
C2	-0.663	1.248
Br3	1.784	-0.276
Br4	-1.784	-0.276
H5	1.213	2.180
H6	-1.213	2.180

	C1	C2	Br3	Br4	H5	H6
C1		1.3254	1.8919	2.8824	1.0825	2.0944
C2	1.3254		2.8824	1.8919	2.0944	1.0825
Br3	1.8919	2.8824		3.5678	2.5218	3.8746
Br4	2.8824	1.8919	3.5678		3.8746	2.5218
H5	1.0825	2.0944	2.5218	3.8746		2.4255
H6	2.0944	1.0825	3.8746	2.5218	2.4255

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	126.344	C1	C2	H6	120.537
C2	C1	Br3	126.344	C2	C1	H5	120.537
Br3	C1	H5	113.120	Br4	C2	H6	113.120

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

using model chemistry: B3LYP/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	-0.297
2	C	-0.297
3	Br	0.035
4	Br	0.035
5	H	0.262
6	H	0.262

	x	y	z	Total
	0.000	0.000	1.710	1.710
CHELPG
AIM
ESP

<r²>	293.993
(<r²>)^1/2	17.146