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	hartrees
Energy at 0K	-189.338833
Energy at 298.15K	-189.334255
HF Energy	-188.556102
Nuclear repulsion energy	68.496261

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3406	3406	3.30
2	A'	3277	3277	15.67
3	A'	1936	1936	134.78
4	A'	1596	1596	20.87
5	A'	1355	1355	18.40
6	A'	462	462	53.56
7	A'	446	446	11.87
8	A"	1303	1303	4.35
9	A"	622	622	0.24

Atom	x (Å)	y (Å)
O1	0.000	0.508
C2	1.060	-0.049
H3	1.099	-1.130
H4	1.959	0.554
O5	-1.177	-0.399

	O1	C2	H3	H4	O5
O1		1.1969	1.9722	1.9594	1.4860
C2	1.1969		1.0816	1.0825	2.2638
H3	1.9722	1.0816		1.8903	2.3902
H4	1.9594	1.0825	1.8903		3.2774
O5	1.4860	2.2638	2.3902	3.2774

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	H3	119.808		O1	C2	H4	118.466
C2	O1	O5	114.651		H3	C2	H4	121.726

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

using model chemistry: CBS-Q

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: CBS-Q

States and conformations

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