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	hartrees
Energy at 0K	-5221.621719
Energy at 298.15K	-5221.629532
HF Energy	-5221.621719
Nuclear repulsion energy	426.755458

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3386	3076	1.65
2	A₁	1791	1627	32.09
3	A₁	1295	1177	3.42
4	A₁	618	561	10.05
5	A₁	118	107	0.07
6	A₂	1046	951	0.00
7	A₂	418	380	0.00
8	B₁	773	702	73.76
9	B₂	3361	3054	17.86
10	B₂	1406	1278	64.18
11	B₂	819	744	72.99
12	B₂	506	460	3.62

Atom	y (Å)	z (Å)
C1	0.655	1.235
C2	-0.655	1.235
Br3	1.775	-0.273
Br4	-1.775	-0.273
H5	1.194	2.162
H6	-1.194	2.162

	C1	C2	Br3	Br4	H5	H6
C1		1.3108	1.8786	2.8607	1.0720	2.0685
C2	1.3108		2.8607	1.8786	2.0685	1.0720
Br3	1.8786	2.8607		3.5507	2.5039	3.8401
Br4	2.8607	1.8786	3.5507		3.8401	2.5039
H5	1.0720	2.0685	2.5039	3.8401		2.3874
H6	2.0685	1.0720	3.8401	2.5039	2.3874

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	126.594	C1	C2	H6	120.142
C2	C1	Br3	126.594	C2	C1	H5	120.142
Br3	C1	H5	113.264	Br4	C2	H6	113.264

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

using model chemistry: HF/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	-0.176
2	C	-0.176
3	Br	0.004
4	Br	0.004
5	H	0.172
6	H	0.172

	x	y	z	Total
	0.000	0.000	2.035	2.035
CHELPG
AIM
ESP

<r²>	291.301
(<r²>)^1/2	17.068