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	hartrees
Energy at 0K	-189.134093
Energy at 298.15K	-189.136671
HF Energy	-188.576842
Nuclear repulsion energy	70.387510

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3378	3274	1.98
2	A'	3190	3092	16.25
3	A'	1467	1422	5.53
4	A'	1291	1251	10.41
5	A'	1184	1148	198.79
6	A'	1015	984	859.56
7	A'	552	535	20.99
8	A"	810	786	34.86
9	A"	677	657	23.12

Atom	x (Å)	y (Å)
O1	0.000	0.453
C2	1.068	-0.277
H3	0.950	-1.361
H4	1.991	0.296
O5	-1.169	-0.112

	O1	C2	H3	H4	O5
O1		1.2938	2.0478	1.9969	1.2983
C2	1.2938		1.0906	1.0863	2.2427
H3	2.0478	1.0906		1.9575	2.4588
H4	1.9969	1.0863	1.9575		3.1857
O5	1.2983	2.2427	2.4588	3.1857

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	H3	118.120		O1	C2	H4	113.783
C2	O1	O5	119.816		H3	C2	H4	128.097

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

using model chemistry: MP2=FULL/aug-cc-pVDZ

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: MP2=FULL/aug-cc-pVDZ

States and conformations

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