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	hartrees
Energy at 0K	-189.705183
Energy at 298.15K	-189.708262
HF Energy	-189.179257
Nuclear repulsion energy	74.104571

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3820	3611	42.96
2	A	3353	3170	3.71
3	A	3208	3033	9.70
4	A	1475	1394	6.85
5	A	1389	1313	45.59
6	A	1207	1141	23.01
7	A	1160	1097	26.10
8	A	861	814	8.79
9	A	774	731	34.60
10	A	484	457	1.46
11	A	259	245	36.52
12	A	177	167	135.04

Atom	x (Å)	y (Å)	z (Å)
C1	1.150	0.265	0.115
O2	0.072	-0.569	-0.083
O3	-1.131	0.259	-0.066
H4	1.059	1.267	-0.278
H5	2.070	-0.299	0.044
H6	-1.556	-0.081	0.737

	C1	O2	O3	H4	H5	H6
C1		1.3772	2.2886	1.0808	1.0809	2.7977
O2	1.3772		1.4609	2.0936	2.0197	1.8868
O3	2.2886	1.4609		2.4201	3.2511	0.9700
H4	1.0808	2.0936	2.4201		1.8919	3.1118
H5	1.0809	2.0197	3.2511	1.8919		3.6973
H6	2.7977	1.8868	0.9700	3.1118	3.6973

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	O3	107.450	O2	C1	H4	116.292
O2	C1	H5	109.911	O2	O3	H6	99.850
H4	C1	H5	122.132

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

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

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

States and conformations

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