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	hartrees
Energy at 0K	-188.900493
Energy at 298.15K	-188.903243
HF Energy	-188.537170
Nuclear repulsion energy	68.711139

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3133	3024	29.88
2	A₁	1536	1483	0.38
3	A₁	1101	1062	8.67
4	A₁	682	659	0.46
5	A₂	964	931	0.00
6	B₁	3267	3154	29.49
7	B₁	1130	1091	4.20
8	B₂	1250	1207	0.31
9	B₂	852	822	35.98

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.778
H2	0.939	0.000	1.338
H3	-0.939	0.000	1.338
O4	0.000	0.820	-0.459
O5	0.000	-0.820	-0.459

	C1	H2	H3	O4	O5
C1		1.0935	1.0935	1.4844	1.4844
H2	1.0935		1.8786	2.1875	2.1875
H3	1.0935	1.8786		2.1875	2.1875
O4	1.4844	2.1875	2.1875		1.6394
O5	1.4844	2.1875	2.1875	1.6394

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	O5	56.483	C1	O5	O4	56.483
H2	C1	H3	118.401	H2	C1	O4	115.271
H2	C1	O5	115.271	H3	C1	O4	115.271
H3	C1	O5	115.271	O4	C1	O5	67.035

All results from a given calculation for CH₂O₂ (Dioxirane)

using model chemistry: MP2/SDD

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: MP2/SDD

States and conformations

All results from a given calculation for CH₂O₂ (Dioxirane)