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	hartrees
Energy at 0K	-188.865661
Energy at 298.15K	-188.868449
HF Energy	-188.497412
Nuclear repulsion energy	69.796457

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3129	3003	7.51
2	A₁	1578	1514	0.66
3	A₁	1177	1130	10.77
4	A₁	704	675	0.46
5	A₂	1023	981	0.00
6	B₁	3235	3104	27.73
7	B₁	1161	1114	7.60
8	B₂	1274	1222	0.61
9	B₂	848	813	15.88

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.761
H2	0.930	0.000	1.329
H3	-0.930	0.000	1.329
O4	0.000	0.807	-0.451
O5	0.000	-0.807	-0.451

	C1	H2	H3	O4	O5
C1		1.0902	1.0902	1.4564	1.4564
H2	1.0902		1.8607	2.1651	2.1651
H3	1.0902	1.8607		2.1651	2.1651
O4	1.4564	2.1651	2.1651		1.6140
O5	1.4564	2.1651	2.1651	1.6140

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	O5	56.351	C1	O5	O4	56.351
H2	C1	H3	117.166	H2	C1	O4	115.717
H2	C1	O5	115.717	H3	C1	O4	115.717
H3	C1	O5	115.717	O4	C1	O5	67.297

All results from a given calculation for CH₂O₂ (Dioxirane)

using model chemistry: CCD/6-31G

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 CH2O2 (Dioxirane)

using model chemistry: CCD/6-31G

States and conformations

All results from a given calculation for CH₂O₂ (Dioxirane)