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	hartrees
Energy at 0K	-5183.558538
Energy at 298.15K
HF Energy	-5183.166567
Nuclear repulsion energy	337.563072

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3264	3102	1.24	105.12	0.24	0.39
2	A'	654	622	12.65	5.09	0.57	0.72
3	A'	504	479	19.24	7.60	0.02	0.04
4	A'	191	182	0.04	3.97	0.55	0.71
5	A"	1202	1142	60.71	2.85	0.75	0.86
6	A"	805	765	123.42	1.03	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.007	0.839	0.000
H2	-0.533	1.789	0.000
Br3	0.007	-0.097	1.613
Br4	0.007	-0.097	-1.613

	C1	H2	Br3	Br4
C1		1.0927	1.8651	1.8651
H2	1.0927		2.5399	2.5399
Br3	1.8651	2.5399		3.2265
Br4	1.8651	2.5399	3.2265

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	Br3	115.872		H2	C1	Br4	115.872
Br3	C1	Br4	119.754

All results from a given calculation for CHBr₂ (dibromomethyl radical)

using model chemistry: MP2=FULL/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 CHBr2 (dibromomethyl radical)

using model chemistry: MP2=FULL/cc-pVDZ

States and conformations

All results from a given calculation for CHBr₂ (dibromomethyl radical)