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	hartrees
Energy at 0K	-2637.294034
Energy at 298.15K	-2637.299625
HF Energy	-2637.075854
Nuclear repulsion energy	141.507671

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3289	3140	4.96
2	A'	3267	3118	2.57
3	A'	3194	3049	0.57
4	A'	1671	1595	29.55
5	A'	1501	1432	14.08
6	A'	1342	1281	31.79
7	A'	1090	1040	6.08
8	A'	598	570	13.88
9	A'	352	336	0.15
10	A"	1041	993	51.91
11	A"	999	954	33.34
12	A"	625	596	16.10

Atom	x (Å)	y (Å)
C1	0.462	-1.149
C2	-0.444	-2.126
Br3	0.000	0.745
H4	1.529	-1.323
H5	-0.131	-3.165
H6	-1.508	-1.926

	C1	C2	Br3	H4	H5	H6
C1		1.3320	1.9492	1.0813	2.1016	2.1178
C2	1.3320		2.9048	2.1299	1.0854	1.0836
Br3	1.9492	2.9048		2.5716	3.9122	3.0669
H4	1.0813	2.1299	2.5716		2.4799	3.0968
H5	2.1016	1.0854	3.9122	2.4799		1.8534
H6	2.1178	1.0836	3.0669	3.0968	1.8534

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	120.424	C1	C2	H6	122.164
C2	C1	Br3	123.470	C2	C1	H4	123.572
Br3	C1	H4	112.958	H5	C2	H6	117.412

All results from a given calculation for C₂H₃Br (vinyl bromide)

using model chemistry: MP2/3-21G

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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All results from a given calculation for C2H3Br (vinyl bromide)

using model chemistry: MP2/3-21G

States and conformations

All results from a given calculation for C₂H₃Br (vinyl bromide)