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	hartrees
Energy at 0K	-5224.912148
Energy at 298.15K	-5224.919791
HF Energy	-5224.912148
Nuclear repulsion energy	428.379663

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3241	3112	0.20
2	A₁	1656	1590	36.51
3	A₁	1184	1137	1.52
4	A₁	599	576	8.52
5	A₁	108	104	0.02
6	A₂	906	870	0.00
7	A₂	387	372	0.00
8	B₁	692	664	76.40
9	B₂	3218	3091	17.77
10	B₂	1286	1235	41.11
11	B₂	774	743	75.14
12	B₂	482	463	2.13

Atom	y (Å)	z (Å)
C1	0.662	1.242
C2	-0.662	1.242
Br3	1.760	-0.275
Br4	-1.760	-0.275
H5	1.212	2.175
H6	-1.212	2.175

	C1	C2	Br3	Br4	H5	H6
C1		1.3248	1.8731	2.8588	1.0826	2.0936
C2	1.3248		2.8588	1.8731	2.0936	1.0826
Br3	1.8731	2.8588		3.5210	2.5107	3.8521
Br4	2.8588	1.8731	3.5210		3.8521	2.5107
H5	1.0826	2.0936	2.5107	3.8521		2.4241
H6	2.0936	1.0826	3.8521	2.5107	2.4241

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	125.892	C1	C2	H6	120.512
C2	C1	Br3	125.892	C2	C1	H5	120.512
Br3	C1	H5	113.596	Br4	C2	H6	113.596

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

using model chemistry: HSEh1PBE/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	-0.219
2	C	-0.219
3	Br	0.034
4	Br	0.034
5	H	0.184
6	H	0.184

	x	y	z	Total
	0.000	0.000	1.677	1.677
CHELPG
AIM
ESP

<r²>	287.802
(<r²>)^1/2	16.965