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	hartrees
Energy at 0K	-189.209434
Energy at 298.15K	-189.212313
HF Energy	-188.652567
Nuclear repulsion energy	73.493880

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3116	3116	30.99
2	A₁	1589	1589	5.85
3	A₁	1348	1348	41.75
4	A₁	786	786	0.98
5	A₂	1061	1061	0.00
6	B₁	3209	3209	36.63
7	B₁	1211	1211	13.04
8	B₂	1299	1299	0.99
9	B₂	949	949	21.33

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.727
H2	0.927	0.000	1.300
H3	-0.927	0.000	1.300
O4	0.000	0.749	-0.435
O5	0.000	-0.749	-0.435

	C1	H2	H3	O4	O5
C1		1.0901	1.0901	1.3827	1.3827
H2	1.0901		1.8542	2.1054	2.1054
H3	1.0901	1.8542		2.1054	2.1054
O4	1.3827	2.1054	2.1054		1.4986
O5	1.3827	2.1054	2.1054	1.4986

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	O5	57.186	C1	O5	O4	57.186
H2	C1	H3	116.525	H2	C1	O4	116.238
H2	C1	O5	116.238	H3	C1	O4	116.238
H3	C1	O5	116.238	O4	C1	O5	65.628

All results from a given calculation for CH₂O₂ (Dioxirane)

using model chemistry: CCSD/6-311G**

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: CCSD/6-311G**

States and conformations

All results from a given calculation for CH₂O₂ (Dioxirane)