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	hartrees
Energy at 0K	-189.688106
Energy at 298.15K	-189.691301
HF Energy	-189.183996
Nuclear repulsion energy	74.450410

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3777	3590	43.86
2	A	3342	3176	4.35
3	A	3188	3030	10.71
4	A	1453	1381	6.63
5	A	1378	1310	52.06
6	A	1221	1160	39.50
7	A	1171	1113	8.57
8	A	894	850	10.05
9	A	786	747	34.07
10	A	493	468	1.61
11	A	304	289	27.00
12	A	196	187	112.15

Atom	x (Å)	y (Å)	z (Å)
C1	1.135	0.271	0.109
O2	0.072	-0.572	-0.072
O3	-1.132	0.237	-0.080
H4	1.041	1.276	-0.309
H5	2.070	-0.289	0.042
H6	-1.439	0.065	0.827

	C1	O2	O3	H4	H5	H6
C1		1.3678	2.2752	1.0931	1.0923	2.6795
O2	1.3678		1.4512	2.0997	2.0205	1.8698
O3	2.2752	1.4512		2.4196	3.2476	0.9729
H4	1.0931	2.0997	2.4196		1.9064	2.9843
H5	1.0923	2.0205	3.2476	1.9064		3.6126
H6	2.6795	1.8698	0.9729	2.9843	3.6126

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	O3	107.588	O2	C1	H4	116.690
O2	C1	H5	109.928	O2	O3	H6	99.042
H4	C1	H5	121.465

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

using model chemistry: MP2=FULL/cc-pVDZ

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=FULL/cc-pVDZ

States and conformations

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