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	hartrees
Energy at 0K	-189.266974
Energy at 298.15K	-189.269572
HF Energy	-188.630311
Nuclear repulsion energy	70.705545

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3316	3096	0.47
2	A'	3164	2954	4.90
3	A'	1615	1508	46.89
4	A'	1443	1347	15.66
5	A'	1266	1182	23.92
6	A'	824	769	270.03
7	A'	522	488	7.93
8	A"	1023	955	30.42
9	A"	714	666	1.70

Atom	x (Å)	y (Å)
O1	0.000	0.461
C2	1.055	-0.192
H3	0.997	-1.272
H4	1.967	0.386
O5	-1.162	-0.206

	O1	C2	H3	H4	O5
O1		1.2410	1.9996	1.9684	1.3401
C2	1.2410		1.0817	1.0794	2.2171
H3	1.9996	1.0817		1.9207	2.4075
H4	1.9684	1.0794	1.9207		3.1844
O5	1.3401	2.2171	2.4075	3.1844

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	H3	118.675		O1	C2	H4	115.886
C2	O1	O5	118.355		H3	C2	H4	125.439

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

using model chemistry: CCD/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: CCD/cc-pVTZ

States and conformations

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