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	hartrees
Energy at 0K	-5222.323258
Energy at 298.15K	-5222.330923
HF Energy	-5221.640731
Nuclear repulsion energy	428.677945

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3273	3273	0.01
2	A₁	1665	1665	25.71
3	A₁	1203	1203	2.24
4	A₁	606	606	6.35
5	A₁	111	111	0.05
6	A₂	924	924	0.00
7	A₂	383	383	0.00
8	B₁	699	699	54.42
9	B₂	3249	3249	16.62
10	B₂	1314	1314	44.59
11	B₂	783	783	48.70
12	B₂	483	483	1.58

Atom	y (Å)	z (Å)
C1	0.663	1.245
C2	-0.663	1.245
Br3	1.757	-0.276
Br4	-1.757	-0.276
H5	1.205	2.177
H6	-1.205	2.177

	C1	C2	Br3	Br4	H5	H6
C1		1.3259	1.8736	2.8585	1.0783	2.0879
C2	1.3259		2.8585	1.8736	2.0879	1.0783
Br3	1.8736	2.8585		3.5150	2.5141	3.8463
Br4	2.8585	1.8736	3.5150		3.8463	2.5141
H5	1.0783	2.0879	2.5141	3.8463		2.4107
H6	2.0879	1.0783	3.8463	2.5141	2.4107

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	125.744	C1	C2	H6	120.198
C2	C1	Br3	125.744	C2	C1	H5	120.198
Br3	C1	H5	114.058	Br4	C2	H6	114.058

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

using model chemistry: MP3/6-311+G(3df,2p)

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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