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	hartrees
Energy at 0K	-2650.496236
Energy at 298.15K	-2650.501806
HF Energy	-2649.943243
Nuclear repulsion energy	145.314646

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3299	3132	0.61
2	A'	3252	3088	4.60
3	A'	3193	3032	0.02
4	A'	1649	1566	41.22
5	A'	1415	1344	10.33
6	A'	1293	1227	21.24
7	A'	1027	975	8.26
8	A'	641	608	19.22
9	A'	349	331	0.02
10	A"	991	941	34.34
11	A"	925	879	28.85
12	A"	607	576	14.18

Atom	x (Å)	y (Å)
C1	0.460	-1.098
C2	-0.445	-2.070
Br3	0.000	0.721
H4	1.527	-1.262
H5	-0.116	-3.100
H6	-1.506	-1.872

	C1	C2	Br3	H4	H5	H6
C1		1.3276	1.8766	1.0787	2.0829	2.1128
C2	1.3276		2.8258	2.1304	1.0811	1.0795
Br3	1.8766	2.8258		2.5023	3.8224	2.9982
H4	1.0787	2.1304	2.5023		2.4653	3.0931
H5	2.0829	1.0811	3.8224	2.4653		1.8543
H6	2.1128	1.0795	2.9982	3.0931	1.8543

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.352	C1	C2	H6	122.405
C2	C1	Br3	122.825	C2	C1	H4	124.259
Br3	C1	H4	112.916	H5	C2	H6	118.243

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

using model chemistry: MP2/cc-pVTZ

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/cc-pVTZ

States and conformations

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