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	hartrees
Energy at 0K	-189.877268
Energy at 298.15K	-189.880449
HF Energy	-189.246479
Nuclear repulsion energy	74.856869

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3785	3594	43.37
2	A	3340	3171	1.93
3	A	3187	3027	8.30
4	A	1463	1389	4.65
5	A	1385	1315	54.93
6	A	1223	1161	38.55
7	A	1175	1116	9.80
8	A	906	860	12.74
9	A	733	696	40.05
10	A	492	467	1.50
11	A	303	287	30.20
12	A	196	186	102.33

Atom	x (Å)	y (Å)	z (Å)
C1	1.131	0.271	0.098
O2	0.072	-0.571	-0.064
O3	-1.129	0.230	-0.083
H4	1.025	1.266	-0.302
H5	2.059	-0.275	0.056
H6	-1.414	0.116	0.834

	C1	O2	O3	H4	H5	H6
C1		1.3620	2.2673	1.0779	1.0777	2.6539
O2	1.3620		1.4440	2.0832	2.0117	1.8682
O3	2.2673	1.4440		2.4007	3.2304	0.9672
H4	1.0779	2.0832	2.4007		1.8902	2.9269
H5	1.0777	2.0117	3.2304	1.8902		3.5806
H6	2.6539	1.8682	0.9672	2.9269	3.5806

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	O3	107.769	O2	C1	H4	116.775
O2	C1	H5	110.545	O2	O3	H6	99.678
H4	C1	H5	122.530

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

using model chemistry: MP2/cc-pVTZ

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: MP2/cc-pVTZ

States and conformations

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