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	hartrees
Energy at 0K	-189.649301
Energy at 298.15K	-189.652527
HF Energy	-189.163547
Nuclear repulsion energy	74.525859

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3762	3531	37.39
2	A	3345	3140	6.69
3	A	3206	3009	10.32
4	A	1493	1402	8.57
5	A	1436	1348	57.63
6	A	1240	1163	32.28
7	A	1200	1126	18.80
8	A	928	871	9.56
9	A	810	760	34.14
10	A	500	470	1.93
11	A	300	282	41.06
12	A	213	200	120.51

Atom	x (Å)	y (Å)	z (Å)
C1	1.138	0.268	0.110
O2	0.069	-0.570	-0.072
O3	-1.129	0.240	-0.079
H4	1.046	1.265	-0.306
H5	2.066	-0.288	0.043
H6	-1.465	0.057	0.816

	C1	O2	O3	H4	H5	H6
C1		1.3713	2.2750	1.0841	1.0840	2.7062
O2	1.3713		1.4456	2.0926	2.0206	1.8803
O3	2.2750	1.4456		2.4153	3.2404	0.9738
H4	1.0841	2.0926	2.4153		1.8907	3.0048
H5	1.0840	2.0206	3.2404	1.8907		3.6316
H6	2.7062	1.8803	0.9738	3.0048	3.6316

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	O3	107.707	O2	C1	H4	116.429
O2	C1	H5	110.218	O2	O3	H6	100.176
H4	C1	H5	121.408

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

using model chemistry: MP3/6-31G*

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: MP3/6-31G*

States and conformations

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