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	hartrees
Energy at 0K	-189.682030
Energy at 298.15K	-189.685250
HF Energy	-189.173455
Nuclear repulsion energy	74.537528

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3857	3616	31.20
2	A	3367	3157	8.10
3	A	3224	3023	12.06
4	A	1499	1406	10.00
5	A	1418	1330	57.36
6	A	1234	1157	31.50
7	A	1196	1121	17.85
8	A	921	863	9.61
9	A	808	757	29.20
10	A	497	466	1.80
11	A	296	277	35.51
12	A	211	198	117.62

Atom	x (Å)	y (Å)	z (Å)
C1	1.139	0.269	0.110
O2	0.069	-0.571	-0.072
O3	-1.129	0.242	-0.078
H4	1.047	1.262	-0.303
H5	2.064	-0.285	0.042
H6	-1.469	0.048	0.806

	C1	O2	O3	H4	H5	H6
C1		1.3725	2.2757	1.0799	1.0799	2.7083
O2	1.3725		1.4475	2.0910	2.0184	1.8760
O3	2.2757	1.4475		2.4136	3.2378	0.9674
H4	1.0799	2.0910	2.4136		1.8834	3.0056
H5	1.0799	2.0184	3.2378	1.8834		3.6296
H6	2.7083	1.8760	0.9674	3.0056	3.6296

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	O3	107.575	O2	C1	H4	116.491
O2	C1	H5	110.213	O2	O3	H6	100.041
H4	C1	H5	121.397

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)