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	hartrees
Energy at 0K	-2650.535717
Energy at 298.15K	-2650.541287
HF Energy	-2649.944357
Nuclear repulsion energy	144.951953

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3271	3126	1.88
2	A'	3242	3099	3.70
3	A'	3175	3035	0.20
4	A'	1675	1601	39.11
5	A'	1421	1358	9.95
6	A'	1300	1243	23.58
7	A'	1033	987	6.34
8	A'	631	603	19.17
9	A'	348	333	0.03
10	A"	987	944	30.84
11	A"	945	903	25.62
12	A"	605	578	15.42

Atom	x (Å)	y (Å)
C1	0.460	-1.105
C2	-0.444	-2.075
Br3	0.000	0.724
H4	1.527	-1.269
H5	-0.120	-3.107
H6	-1.506	-1.876

	C1	C2	Br3	H4	H5	H6
C1		1.3257	1.8859	1.0788	2.0844	2.1120
C2	1.3257		2.8332	2.1290	1.0820	1.0806
Br3	1.8859	2.8332		2.5100	3.8326	3.0041
H4	1.0788	2.1290	2.5100		2.4682	3.0929
H5	2.0844	1.0820	3.8326	2.4682		1.8539
H6	2.1120	1.0806	3.0041	3.0929	1.8539

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.584	C1	C2	H6	122.400
C2	C1	Br3	122.860	C2	C1	H4	124.292
Br3	C1	H4	112.848	H5	C2	H6	118.017

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

using model chemistry: CCSD/aug-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: CCSD/aug-cc-pVTZ

States and conformations

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