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	hartrees
Energy at 0K	-2647.760748
Energy at 298.15K	-2647.766289
HF Energy	-2647.344420
Nuclear repulsion energy	143.762840

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3333	3138	4.26
2	A'	3300	3107	5.22
3	A'	3232	3042	0.87
4	A'	1700	1601	27.88
5	A'	1449	1364	10.50
6	A'	1316	1239	29.36
7	A'	1048	987	6.47
8	A'	611	575	20.14
9	A'	351	330	0.09
10	A"	987	929	38.91
11	A"	928	874	17.76
12	A"	596	561	10.44

Atom	x (Å)	y (Å)
C1	0.467	-1.120
C2	-0.449	-2.087
Br3	0.000	0.730
H4	1.533	-1.289
H5	-0.135	-3.123
H6	-1.509	-1.879

	C1	C2	Br3	H4	H5	H6
C1		1.3321	1.9076	1.0792	2.0910	2.1165
C2	1.3321		2.8525	2.1367	1.0817	1.0802
Br3	1.9076	2.8525		2.5344	3.8545	3.0135
H4	1.0792	2.1367	2.5344		2.4789	3.0985
H5	2.0910	1.0817	3.8545	2.4789		1.8531
H6	2.1165	1.0802	3.0135	3.0985	1.8531

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.695	C1	C2	H6	122.311
C2	C1	Br3	122.396	C2	C1	H4	124.443
Br3	C1	H4	113.162	H5	C2	H6	117.994

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

using model chemistry: QCISD/6-31G**

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: QCISD/6-31G**

States and conformations

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