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	hartrees
Energy at 0K	-5225.737310
Energy at 298.15K	-5225.744801
HF Energy	-5225.737310
Nuclear repulsion energy	419.748152

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3142	3134	0.33
2	A₁	1563	1559	42.09
3	A₁	1151	1148	1.58
4	A₁	541	539	9.55
5	A₁	102	102	0.02
6	A₂	850	848	0.00
7	A₂	370	369	0.00
8	B₁	658	656	71.01
9	B₂	3121	3113	14.30
10	B₂	1244	1241	51.39
11	B₂	720	718	76.41
12	B₂	451	450	4.63

Atom	y (Å)	z (Å)
C1	0.667	1.260
C2	-0.667	1.260
Br3	1.803	-0.279
Br4	-1.803	-0.279
H5	1.223	2.194
H6	-1.223	2.194

	C1	C2	Br3	Br4	H5	H6
C1		1.3330	1.9129	2.9097	1.0873	2.1078
C2	1.3330		2.9097	1.9129	2.1078	1.0873
Br3	1.9129	2.9097		3.6063	2.5398	3.9079
Br4	2.9097	1.9129	3.6063		3.9079	2.5398
H5	1.0873	2.1078	2.5398	3.9079		2.4461
H6	2.1078	1.0873	3.9079	2.5398	2.4461

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	126.455	C1	C2	H6	120.786
C2	C1	Br3	126.455	C2	C1	H5	120.786
Br3	C1	H5	112.759	Br4	C2	H6	112.759

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

using model chemistry: BLYP/TZVP

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	-0.137
2	C	-0.137
3	Br	-0.036
4	Br	-0.036
5	H	0.173
6	H	0.173

	x	y	z	Total
	0.000	0.000	1.606	1.606
CHELPG
AIM
ESP

<r²>	299.780
(<r²>)^1/2	17.314