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	hartrees
Energy at 0K	-5178.195983
Energy at 298.15K
HF Energy	-5178.195983
Nuclear repulsion energy	337.709003

Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
A'	3423	2930	1.86
A'	710	608	15.61
A'	581	497	5.71
A'	195	167	0.07
A"	1311	1122	86.87
A"	809	693	113.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.008	0.853	0.000
H2	-0.575	1.751	0.000
Br3	0.008	-0.098	1.611
Br4	0.008	-0.098	-1.611

	C1	H2	Br3	Br4
C1		1.0704	1.8705	1.8705
H2	1.0704		2.5204	2.5204
Br3	1.8705	2.5204		3.2214
Br4	1.8705	2.5204	3.2214

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	Br3	115.242		H2	C1	Br4	115.242
Br3	C1	Br4	118.881

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

using model chemistry: ROHF/6-31+G**

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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Number	Element	Mulliken
1	C	-0.057
2	H	0.249
3	Br	-0.096
4	Br	-0.096

	x	y	z	Total
	-0.505	1.028	0.000	1.146
CHELPG
AIM
ESP

<r²>	216.716
(<r²>)^1/2	14.721

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

using model chemistry: ROHF/6-31+G**

States and conformations

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