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	hartrees
Energy at 0K	-187.854496
Energy at 298.15K	-187.856876
HF Energy	-187.521687
Nuclear repulsion energy	66.575094

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3248	3107	4.44
2	A'	3120	2985	1.99
3	A'	1589	1520	1.85
4	A'	1471	1407	2.96
5	A'	1233	1180	6.40
6	A'	621	594	16.96
7	A'	413	395	0.98
8	A"	1090	1043	28.53
9	A"	635	607	0.03

Atom	x (Å)	y (Å)
O1	0.000	0.531
C2	1.101	-0.087
H3	1.102	-1.174
H4	2.023	0.489
O5	-1.216	-0.380

	O1	C2	H3	H4	O5
O1		1.2625	2.0305	2.0232	1.5193
C2	1.2625		1.0869	1.0877	2.3350
H3	2.0305	1.0869		1.9015	2.4506
H4	2.0232	1.0877	1.9015		3.3535
O5	1.5193	2.3350	2.4506	3.3535

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	H3	119.412		O1	C2	H4	118.643
C2	O1	O5	113.837		H3	C2	H4	121.945

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

using model chemistry: CCD/3-21G*

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/3-21G*

States and conformations

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