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	hartrees
Energy at 0K	-189.307322
Energy at 298.15K	-189.309945
HF Energy	-188.629825
Nuclear repulsion energy	71.132348

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3343	3118	0.76
2	A'	3209	2993	8.55
3	A'	1628	1518	57.03
4	A'	1457	1359	21.73
5	A'	1284	1198	29.80
6	A'	856	798	333.61
7	A'	534	498	9.38
8	A"	1027	958	33.33
9	A"	725	677	2.01

Atom	x (Å)	y (Å)
O1	0.000	0.455
C2	1.051	-0.199
H3	0.990	-1.273
H4	1.959	0.373
O5	-1.157	-0.194

	O1	C2	H3	H4	O5
O1		1.2380	1.9921	1.9604	1.3262
C2	1.2380		1.0758	1.0733	2.2072
H3	1.9921	1.0758		1.9103	2.4026
H4	1.9604	1.0733	1.9103		3.1663
O5	1.3262	2.2072	2.4026	3.1663

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	H3	118.686		O1	C2	H4	115.846
C2	O1	O5	118.771		H3	C2	H4	125.468

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

using model chemistry: MP3=FULL/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: MP3=FULL/cc-pVTZ

States and conformations

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