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	hartrees
Energy at 0K	-5222.211445
Energy at 298.15K	-5222.219100
HF Energy	-5221.640203
Nuclear repulsion energy	425.835744

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3287	3091	0.92
2	A₁	1682	1581	26.11
3	A₁	1195	1123	2.37
4	A₁	602	566	7.42
5	A₁	111	104	0.05
6	A₂	917	862	0.00
7	A₂	382	360	0.00
8	B₁	704	662	58.01
9	B₂	3264	3069	13.14
10	B₂	1305	1227	42.78
11	B₂	779	733	49.34
12	B₂	482	453	1.61

Atom	y (Å)	z (Å)
C1	0.670	1.250
C2	-0.670	1.250
Br3	1.770	-0.277
Br4	-1.770	-0.277
H5	1.216	2.195
H6	-1.216	2.195

	C1	C2	Br3	Br4	H5	H6
C1		1.3393	1.8825	2.8784	1.0915	2.1092
C2	1.3393		2.8784	1.8825	2.1092	1.0915
Br3	1.8825	2.8784		3.5402	2.5335	3.8767
Br4	2.8784	1.8825	3.5402		3.8767	2.5335
H5	1.0915	2.1092	2.5335	3.8767		2.4321
H6	2.1092	1.0915	3.8767	2.5335	2.4321

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	125.774	C1	C2	H6	120.042
C2	C1	Br3	125.774	C2	C1	H5	120.042
Br3	C1	H5	114.184	Br4	C2	H6	114.184

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

using model chemistry: MP3=FULL/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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