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	hartrees
Energy at 0K	-189.383420
Energy at 298.15K	-189.385988
HF Energy	-188.624826
Nuclear repulsion energy	70.134192

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3313	3313
2	A'	3152	3152
3	A'	1496	1496
4	A'	1326	1326
5	A'	1246	1246
6	A'	965	965
7	A'	539	539
8	A"	869	869
9	A"	647	647

Atom	x (Å)	y (Å)
O1	0.000	0.465
C2	1.066	-0.223
H3	0.991	-1.303
H4	1.979	0.352
O5	-1.171	-0.180

	O1	C2	H3	H4	O5
O1		1.2691	2.0267	1.9827	1.3369
C2	1.2691		1.0825	1.0793	2.2376
H3	2.0267	1.0825		1.9280	2.4358
H4	1.9827	1.0793	1.9280		3.1950
O5	1.3369	2.2376	2.4358	3.1950

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	H3	118.834		O1	C2	H4	114.953
C2	O1	O5	118.306		H3	C2	H4	126.213

All results from a given calculation for H₂COO (Dioxymethyl radical)

using model chemistry: CCSD(T)=FULL/6-311+G(3df,2p)

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 H2COO (Dioxymethyl radical)

using model chemistry: CCSD(T)=FULL/6-311+G(3df,2p)

States and conformations

All results from a given calculation for H₂COO (Dioxymethyl radical)