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	hartrees
Energy at 0K	-189.267549
Energy at 298.15K	-189.270160
HF Energy	-188.629527
Nuclear repulsion energy	70.813465

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3314	3125	1.06
2	A'	3160	2980	5.07
3	A'	1625	1532	46.07
4	A'	1446	1364	12.80
5	A'	1270	1198	25.69
6	A'	849	801	257.60
7	A'	529	498	5.45
8	A"	1032	973	26.88
9	A"	716	675	2.26

Atom	x (Å)	y (Å)
O1	0.000	0.460
C2	1.053	-0.190
H3	0.999	-1.271
H4	1.964	0.392
O5	-1.160	-0.208

	O1	C2	H3	H4	O5
O1		1.2373	1.9989	1.9648	1.3385
C2	1.2373		1.0831	1.0805	2.2135
H3	1.9989	1.0831		1.9229	2.4074
H4	1.9648	1.0805	1.9229		3.1809
O5	1.3385	2.2135	2.4074	3.1809

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	H3	118.814		O1	C2	H4	115.756
C2	O1	O5	118.432		H3	C2	H4	125.430

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

using model chemistry: CCD/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: CCD/6-311+G(3df,2p)

States and conformations

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