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	hartrees
Energy at 0K	-2683.567276
Energy at 298.15K	-2683.571231
HF Energy	-2683.185550
Nuclear repulsion energy	144.414219

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3195	2952	23.04
2	A'	1941	1793	419.09
3	A'	1390	1284	85.97
4	A'	679	628	173.97
5	A'	379	351	8.27
6	A"	960	887	2.12

Atom	x (Å)	y (Å)
C1	0.377	-1.199
O2	-0.465	-2.026
H3	1.456	-1.369
Br4	0.000	0.708

	C1	O2	H3	Br4
C1		1.1802	1.0921	1.9439
O2	1.1802		2.0303	2.7732
H3	1.0921	2.0303		2.5362
Br4	1.9439	2.7732	2.5362

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	H3	126.581		O2	C1	Br4	123.298
H3	C1	Br4	110.121

All results from a given calculation for COHBr (Formyl bromide)

using model chemistry: CID/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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