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	hartrees
Energy at 0K	-189.137171
Energy at 298.15K	-189.140030
HF Energy	-188.607163
Nuclear repulsion energy	72.480300

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3177	2984	26.78
2	A₁	1595	1498	4.94
3	A₁	1288	1210	33.46
4	A₁	767	720	1.20
5	A₂	1039	976	0.00
6	B₁	3290	3090	22.83
7	B₁	1199	1126	7.06
8	B₂	1297	1218	0.05
9	B₂	947	890	31.90

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.733
H2	0.925	0.000	1.299
H3	-0.925	0.000	1.299
O4	0.000	0.768	-0.437
O5	0.000	-0.768	-0.437

	C1	H2	H3	O4	O5
C1		1.0843	1.0843	1.4001	1.4001
H2	1.0843		1.8503	2.1119	2.1119
H3	1.0843	1.8503		2.1119	2.1119
O4	1.4001	2.1119	2.1119		1.5368
O5	1.4001	2.1119	2.1119	1.5368

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	O5	56.714	C1	O5	O4	56.714
H2	C1	H3	117.125	H2	C1	O4	115.849
H2	C1	O5	115.849	H3	C1	O4	115.849
H3	C1	O5	115.849	O4	C1	O5	66.572

All results from a given calculation for CH₂O₂ (Dioxirane)

using model chemistry: MP2=FULL/6-31+G**

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=FULL/6-31+G**

States and conformations

All results from a given calculation for CH₂O₂ (Dioxirane)