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	hartrees
Energy at 0K	-189.777576
Energy at 298.15K	-189.780744
HF Energy	-189.223014
Nuclear repulsion energy	74.804741

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3841	3665	33.36
2	A	3293	3142	6.07
3	A	3153	3008	10.39
4	A	1462	1395	6.05
5	A	1414	1349	43.38
6	A	1221	1165	26.73
7	A	1176	1122	16.77
8	A	893	852	7.52
9	A	777	742	34.73
10	A	500	477	1.69
11	A	293	279	32.05
12	A	184	175	117.28

Atom	x (Å)	y (Å)	z (Å)
C1	1.138	0.266	0.108
O2	0.064	-0.565	-0.070
O3	-1.126	0.236	-0.079
H4	1.047	1.265	-0.306
H5	2.063	-0.298	0.042
H6	-1.450	0.073	0.813

	C1	O2	O3	H4	H5	H6
C1		1.3696	2.2721	1.0854	1.0853	2.6898
O2	1.3696		1.4350	2.0904	2.0199	1.8661
O3	2.2721	1.4350		2.4143	3.2359	0.9634
H4	1.0854	2.0904	2.4143		1.8967	2.9845
H5	1.0853	2.0199	3.2359	1.8967		3.6163
H6	2.6898	1.8661	0.9634	2.9845	3.6163

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	O3	108.190	O2	C1	H4	116.267
O2	C1	H5	110.192	O2	O3	H6	100.309
H4	C1	H5	121.801

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

using model chemistry: QCISD/6-311G**

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/6-311G**

States and conformations

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