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	hartrees
Energy at 0K	-2647.992493
Energy at 298.15K	-2647.998084
HF Energy	-2647.529555
Nuclear repulsion energy	146.010459

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3329	3144	0.39
2	A'	3277	3095	4.14
3	A'	3221	3042	0.35
4	A'	1657	1565	32.01
5	A'	1422	1344	7.71
6	A'	1303	1231	18.74
7	A'	1038	980	8.45
8	A'	661	624	16.08
9	A'	355	335	0.04
10	A"	1004	948	28.46
11	A"	934	882	23.41
12	A"	616	582	11.23

Atom	x (Å)	y (Å)
C1	0.463	-1.085
C2	-0.446	-2.056
Br3	0.000	0.715
H4	1.532	-1.248
H5	-0.123	-3.090
H6	-1.509	-1.856

	C1	C2	Br3	H4	H5	H6
C1		1.3293	1.8590	1.0814	2.0884	2.1170
C2	1.3293		2.8065	2.1363	1.0833	1.0817
Br3	1.8590	2.8065		2.4898	3.8070	2.9816
H4	1.0814	2.1363	2.4898		2.4764	3.1011
H5	2.0884	1.0833	3.8070	2.4764		1.8552
H6	2.1170	1.0817	2.9816	3.1011	1.8552

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.563	C1	C2	H6	122.495
C2	C1	Br3	122.479	C2	C1	H4	124.476
Br3	C1	H4	113.046	H5	C2	H6	117.942

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

using model chemistry: MP2/6-31G(2df,p)

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: MP2/6-31G(2df,p)

States and conformations

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