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	hartrees
Energy at 0K	-2647.788212
Energy at 298.15K	-2647.793764
HF Energy	-2647.362656
Nuclear repulsion energy	144.473563

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3357	3153	1.21
2	A'	3306	3105	5.22
3	A'	3247	3050	0.02
4	A'	1677	1575	42.50
5	A'	1444	1356	12.60
6	A'	1320	1240	23.41
7	A'	1047	983	10.74
8	A'	622	585	21.74
9	A'	350	328	0.01
10	A"	991	931	46.83
11	A"	907	852	31.39
12	A"	607	570	17.43

Atom	x (Å)	y (Å)
C1	0.459	-1.105
C2	-0.444	-2.087
Br3	0.000	0.727
H4	1.525	-1.274
H5	-0.106	-3.112
H6	-1.506	-1.893

	C1	C2	Br3	H4	H5	H6
C1		1.3333	1.8886	1.0791	2.0850	2.1164
C2	1.3333		2.8480	2.1297	1.0801	1.0791
Br3	1.8886	2.8480		2.5153	3.8405	3.0215
H4	1.0791	2.1297	2.5153		2.4575	3.0928
H5	2.0850	1.0801	3.8405	2.4575		1.8562
H6	2.1164	1.0791	3.0215	3.0928	1.8562

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.150	C1	C2	H6	122.290
C2	C1	Br3	123.321	C2	C1	H4	123.632
Br3	C1	H4	113.047	H5	C2	H6	118.559

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

using model chemistry: MP2=FULL/6-31+G**

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=FULL/6-31+G**

States and conformations

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