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	hartrees
Energy at 0K	-5225.699090
Energy at 298.15K	-5225.706680
HF Energy	-5225.699090
Nuclear repulsion energy	424.229218

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3222	3125	0.28
2	A₁	1641	1592	37.04
3	A₁	1164	1129	1.53
4	A₁	581	564	9.40
5	A₁	107	104	0.03
6	A₂	882	856	0.00
7	A₂	381	369	0.00
8	B₁	679	659	57.53
9	B₂	3199	3103	15.54
10	B₂	1263	1225	47.15
11	B₂	753	731	68.35
12	B₂	472	458	3.37

Atom	y (Å)	z (Å)
C1	0.667	1.252
C2	-0.667	1.252
Br3	1.779	-0.277
Br4	-1.779	-0.277
H5	1.220	2.192
H6	-1.220	2.192

	C1	C2	Br3	Br4	H5	H6
C1		1.3330	1.8912	2.8845	1.0915	2.1083
C2	1.3330		2.8845	1.8912	2.1083	1.0915
Br3	1.8912	2.8845		3.5587	2.5321	3.8856
Br4	2.8845	1.8912	3.5587		3.8856	2.5321
H5	1.0915	2.1083	2.5321	3.8856		2.4408
H6	2.1083	1.0915	3.8856	2.5321	2.4408

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	126.045	C1	C2	H6	120.493
C2	C1	Br3	126.045	C2	C1	H5	120.493
Br3	C1	H5	113.463	Br4	C2	H6	113.463

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

using model chemistry: B3LYP/cc-pVDZ

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	-0.055
2	C	-0.055
3	Br	-0.005
4	Br	-0.005
5	H	0.060
6	H	0.060

	x	y	z	Total
	0.000	0.000	1.574	1.574
CHELPG
AIM
ESP

<r²>	292.854
(<r²>)^1/2	17.113