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	hartrees
Energy at 0K	-5222.991197
Energy at 298.15K	-5222.998897
HF Energy	-5221.827983
Nuclear repulsion energy	435.009793

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3271	3131	0.01
2	A₁	1626	1556	26.25
3	A₁	1182	1131	1.53
4	A₁	629	602	6.38
5	A₁	112	107	0.03
6	A₂	925	885	0.00
7	A₂	395	378	0.00
8	B₁	704	674	57.03
9	B₂	3251	3111	18.97
10	B₂	1295	1240	37.30
11	B₂	796	762	49.58
12	B₂	491	470	1.37

Atom	y (Å)	z (Å)
C1	0.663	1.243
C2	-0.663	1.243
Br3	1.722	-0.275
Br4	-1.722	-0.275
H5	1.205	2.172
H6	-1.205	2.172

	C1	C2	Br3	Br4	H5	H6
C1		1.3268	1.8504	2.8272	1.0757	2.0870
C2	1.3268		2.8272	1.8504	2.0870	1.0757
Br3	1.8504	2.8272		3.4437	2.5010	3.8152
Br4	2.8272	1.8504	3.4437		3.8152	2.5010
H5	1.0757	2.0870	2.5010	3.8152		2.4105
H6	2.0870	1.0757	3.8152	2.5010	2.4105

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	124.891	C1	C2	H6	120.245
C2	C1	Br3	124.891	C2	C1	H5	120.245
Br3	C1	H5	114.864	Br4	C2	H6	114.864

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

using model chemistry: MP2=FULL/cc-pVQZ

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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