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	hartrees
Energy at 0K	-5194.958358
Energy at 298.15K	-5194.966044
HF Energy	-5194.958358
Nuclear repulsion energy	441.225299

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3171	3119	0.18
2	A₁	1621	1594	32.68
3	A₁	1155	1136	0.22
4	A₁	647	636	8.11
5	A₁	115	113	0.00
6	A₂	900	885	0.00
7	A₂	397	390	0.00
8	B₁	686	675	88.56
9	B₂	3146	3095	17.44
10	B₂	1274	1253	17.57
11	B₂	790	777	58.18
12	B₂	488	480	0.86

Atom	y (Å)	z (Å)
C1	0.665	1.284
C2	-0.665	1.284
Br3	1.664	-0.283
Br4	-1.664	-0.283
H5	1.249	2.207
H6	-1.249	2.207

	C1	C2	Br3	Br4	H5	H6
C1		1.3293	1.8590	2.8070	1.0924	2.1248
C2	1.3293		2.8070	1.8590	2.1248	1.0924
Br3	1.8590	2.8070		3.3275	2.5248	3.8326
Br4	2.8070	1.8590	3.3275		3.8326	2.5248
H5	1.0924	2.1248	2.5248	3.8326		2.4987
H6	2.1248	1.0924	3.8326	2.5248	2.4987

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	122.509	C1	C2	H6	122.357
C2	C1	Br3	122.509	C2	C1	H5	122.357
Br3	C1	H5	115.134	Br4	C2	H6	115.134

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

using model chemistry: LSDA/3-21G

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	-0.269
2	C	-0.269
3	Br	0.009
4	Br	0.009
5	H	0.260
6	H	0.260

	x	y	z	Total
	0.000	0.000	1.376	1.376
CHELPG
AIM
ESP

<r²>	265.893
(<r²>)^1/2	16.306