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	hartrees
Energy at 0K	-5221.829217
Energy at 298.15K	-5221.837035
HF Energy	-5221.829217
Nuclear repulsion energy	428.038016

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3379	3069	0.55
2	A₁	1783	1620	30.86
3	A₁	1292	1173	2.96
4	A₁	620	563	9.01
5	A₁	118	107	0.09
6	A₂	1052	955	0.00
7	A₂	421	382	0.00
8	B₁	774	703	60.81
9	B₂	3354	3047	17.74
10	B₂	1407	1278	64.47
11	B₂	819	744	61.15
12	B₂	508	461	3.67

Atom	y (Å)	z (Å)
C1	0.654	1.233
C2	-0.654	1.233
Br3	1.769	-0.273
Br4	-1.769	-0.273
H5	1.189	2.159
H6	-1.189	2.159

	C1	C2	Br3	Br4	H5	H6
C1		1.3072	1.8740	2.8525	1.0696	2.0624
C2	1.3072		2.8525	1.8740	2.0624	1.0696
Br3	1.8740	2.8525		3.5380	2.4998	3.8295
Br4	2.8525	1.8740	3.5380		3.8295	2.4998
H5	1.0696	2.0624	2.4998	3.8295		2.3786
H6	2.0624	1.0696	3.8295	2.4998	2.3786

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	126.528	C1	C2	H6	120.057
C2	C1	Br3	126.528	C2	C1	H5	120.057
Br3	C1	H5	113.415	Br4	C2	H6	113.415

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

using model chemistry: HF/cc-pVQZ

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	-0.171
2	C	-0.171
3	Br	-0.024
4	Br	-0.024
5	H	0.195
6	H	0.195

	x	y	z	Total
	0.000	0.000	1.984	1.984
CHELPG
AIM
ESP

<r²>	289.633
(<r²>)^1/2	17.019