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	hartrees
Energy at 0K	-5222.387461
Energy at 298.15K	-5222.381565
HF Energy	-5216.643926
Nuclear repulsion energy	388.694356

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3449	3249	0.00
2	A_g	1809	1705	0.00
3	A_g	1412	1330	0.00
4	A_g	816	769	0.00
5	A_g	236	222	0.00
6	A_u	1066	1005	62.64
7	A_u	191	180	0.31
8	B_g	891	839	0.00
9	B_u	3443	3244	15.26
10	B_u	1307	1231	56.97
11	B_u	728	686	84.52
12	B_u	217	205	2.60

Atom	x (Å)	y (Å)
C1	-0.385	0.543
C2	0.385	-0.543
Br3	0.385	2.269
Br4	-0.385	-2.269
H5	-1.468	0.524
H6	1.468	-0.524

	C1	C2	Br3	Br4	H5	H6
C1		1.3321	1.8903	2.8127	1.0830	2.1385
C2	1.3321		2.8127	1.8903	2.1385	1.0830
Br3	1.8903	2.8127		4.6037	2.5461	2.9955
Br4	2.8127	1.8903	4.6037		2.9955	2.5461
H5	1.0830	2.1385	2.5461	2.9955		3.1173
H6	2.1385	1.0830	2.9955	2.5461	3.1173

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Br4	121.303	C1	C2	H6	124.366
C2	C1	Br3	121.303	C2	C1	H5	124.366
Br3	C1	H5	114.332	Br4	C2	H6	114.332

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

using model chemistry: G2

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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