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	hartrees
Energy at 0K	-5225.720235
Energy at 298.15K	-5225.727892
HF Energy	-5225.720235
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3248	3248	2.07
2	A₁	1677	1677	32.95
3	A₁	1218	1218	1.70
4	A₁	601	601	8.31
5	A₁	110	110	0.03
6	A₂	925	925	0.00
7	A₂	390	390	0.00
8	B₁	698	698	77.62
9	B₂	3225	3225	12.67
10	B₂	1319	1319	44.01
11	B₂	781	781	71.41
12	B₂	485	485	2.16

Atom	y (Å)	z (Å)
C1	0.662	1.242
C2	-0.662	1.242
Br3	1.767	-0.275
Br4	-1.767	-0.275
H5	1.207	2.177
H6	-1.207	2.177

	C1	C2	Br3	Br4	H5	H6
C1		1.3233	1.8772	2.8638	1.0825	2.0896
C2	1.3233		2.8638	1.8772	2.0896	1.0825
Br3	1.8772	2.8638		3.5347	2.5153	3.8548
Br4	2.8638	1.8772	3.5347		3.8548	2.5153
H5	1.0825	2.0896	2.5153	3.8548		2.4141
H6	2.0896	1.0825	3.8548	2.5153	2.4141

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	126.086	C1	C2	H6	120.254
C2	C1	Br3	126.086	C2	C1	H5	120.254
Br3	C1	H5	113.660	Br4	C2	H6	113.660

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	-0.314
2	C	-0.314
3	Br	0.038
4	Br	0.038
5	H	0.276
6	H	0.276

	x	y	z	Total
	0.000	0.000	1.734	1.734
CHELPG
AIM
ESP

<r²>	289.438
(<r²>)^1/2	17.013