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	hartrees
Energy at 0K	-188.436998
Energy at 298.15K
HF Energy	-188.131735
Nuclear repulsion energy	72.574454

Atom	x (Å)	y (Å)	z (Å)
C1	1.178	0.260	0.109
O2	0.067	-0.586	-0.094
O3	-1.137	0.307	-0.028
H4	1.116	1.263	-0.288
H5	2.102	-0.301	0.105
H6	-1.724	-0.285	0.508

	C1	O2	O3	H4	H5	H6
C1		1.4107	2.3190	1.0804	1.0812	2.9787
O2	1.4107		1.5003	2.1346	2.0644	1.9128
O3	2.3190	1.5003		2.4610	3.2980	0.9908
H4	1.0804	2.1346	2.4610		1.8900	3.3303
H5	1.0812	2.0644	3.2980	1.8900		3.8467
H6	2.9787	1.9128	0.9908	3.3303	3.8467

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	O3	105.577	O2	C1	H4	117.326
O2	C1	H5	111.193	O2	O3	H6	98.246
H4	C1	H5	121.934

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

using model chemistry: CID/3-21G*

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: CID/3-21G*

States and conformations

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