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	hartrees
Energy at 0K	-189.381906
Energy at 298.15K	-189.384456
HF Energy	-188.631511
Nuclear repulsion energy	69.765982

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3278	3278
2	A'	3152	3152
3	A'	1495	1495
4	A'	1339	1339
5	A'	1230	1230
6	A'	915	915
7	A'	530	530
8	A"	880	880
9	A"	635	635

Atom	x (Å)	y (Å)
O1	0.000	0.472
C2	1.071	-0.211
H3	1.003	-1.289
H4	1.979	0.370
O5	-1.176	-0.199

	O1	C2	H3	H4	O5
O1		1.2700	2.0264	1.9817	1.3538
C2	1.2700		1.0803	1.0777	2.2471
H3	2.0264	1.0803		1.9244	2.4366
H4	1.9817	1.0777	1.9244		3.2060
O5	1.3538	2.2471	2.4366	3.2060

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	H3	118.904		O1	C2	H4	114.911
C2	O1	O5	117.802		H3	C2	H4	126.185

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

using model chemistry: QCISD(T)=FULL/aug-cc-pVTZ

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: QCISD(T)=FULL/aug-cc-pVTZ

States and conformations

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