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	hartrees
Energy at 0K	-189.654476
Energy at 298.15K	-189.657680
HF Energy	-189.163150
Nuclear repulsion energy	74.388280

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3729	3529	32.15
2	A	3323	3146	7.21
3	A	3185	3015	10.53
4	A	1484	1405	8.30
5	A	1428	1352	57.75
6	A	1230	1164	31.32
7	A	1193	1129	18.31
8	A	919	870	9.48
9	A	796	754	34.02
10	A	497	470	1.91
11	A	295	279	40.01
12	A	210	199	120.30

Atom	x (Å)	y (Å)	z (Å)
C1	1.141	0.268	0.110
O2	0.069	-0.571	-0.074
O3	-1.130	0.242	-0.078
H4	1.049	1.268	-0.303
H5	2.069	-0.290	0.045
H6	-1.475	0.043	0.813

	C1	O2	O3	H4	H5	H6
C1		1.3735	2.2786	1.0855	1.0857	2.7172
O2	1.3735		1.4487	2.0964	2.0236	1.8827
O3	2.2786	1.4487		2.4191	3.2458	0.9759
H4	1.0855	2.0964	2.4191		1.8944	3.0190
H5	1.0857	2.0236	3.2458	1.8944		3.6415
H6	2.7172	1.8827	0.9759	3.0190	3.6415

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	O3	107.655	O2	C1	H4	116.490
O2	C1	H5	110.196	O2	O3	H6	100.051
H4	C1	H5	121.500

All results from a given calculation for CH₂OOH (CH2OOH radical)

using model chemistry: CCD/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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All results from a given calculation for CH2OOH (CH2OOH radical)

using model chemistry: CCD/6-31G*

States and conformations

All results from a given calculation for CH₂OOH (CH2OOH radical)