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	hartrees
Energy at 0K	-2650.242428
Energy at 298.15K	-2650.247976
HF Energy	-2649.842148
Nuclear repulsion energy	143.957313

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3316	3159	0.81
2	A'	3259	3104	4.87
3	A'	3202	3050	0.01
4	A'	1655	1576	37.99
5	A'	1403	1336	9.00
6	A'	1281	1221	21.99
7	A'	1020	971	8.85
8	A'	635	605	18.61
9	A'	348	332	0.04
10	A"	980	934	37.08
11	A"	904	861	22.51
12	A"	597	569	12.37

Atom	x (Å)	y (Å)
C1	0.463	-1.105
C2	-0.449	-2.091
Br3	0.000	0.728
H4	1.542	-1.283
H5	-0.107	-3.131
H6	-1.523	-1.889

	C1	C2	Br3	H4	H5	H6
C1		1.3428	1.8909	1.0936	2.1046	2.1351
C2	1.3428		2.8545	2.1487	1.0945	1.0931
Br3	1.8909	2.8545		2.5343	3.8604	3.0277
H4	1.0936	2.1487	2.5343		2.4772	3.1245
H5	2.1046	1.0945	3.8604	2.4772		1.8831
H6	2.1351	1.0931	3.0277	3.1245	1.8831

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.067	C1	C2	H6	122.115
C2	C1	Br3	123.048	C2	C1	H4	123.417
Br3	C1	H4	113.535	H5	C2	H6	118.818

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

using model chemistry: MP2/cc-pVDZ

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-pVDZ

States and conformations

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