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	hartrees
Energy at 0K	-189.254150
Energy at 298.15K	-189.257022
HF Energy	-188.651382
Nuclear repulsion energy	73.194294

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3136	2975	30.58
2	A₁	1583	1501	3.43
3	A₁	1320	1252	34.61
4	A₁	774	734	1.36
5	A₂	1049	995	0.00
6	B₁	3240	3074	34.63
7	B₁	1209	1147	11.44
8	B₂	1298	1231	0.18
9	B₂	961	912	26.64

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.727
H2	0.927	0.000	1.298
H3	-0.927	0.000	1.298
O4	0.000	0.756	-0.435
O5	0.000	-0.756	-0.435

	C1	H2	H3	O4	O5
C1		1.0883	1.0883	1.3866	1.3866
H2	1.0883		1.8536	2.1055	2.1055
H3	1.0883	1.8536		2.1055	2.1055
O4	1.3866	2.1055	2.1055		1.5124
O5	1.3866	2.1055	2.1055	1.5124

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	O5	56.949	C1	O5	O4	56.949
H2	C1	H3	116.771	H2	C1	O4	116.064
H2	C1	O5	116.064	H3	C1	O4	116.064
H3	C1	O5	116.064	O4	C1	O5	66.102

All results from a given calculation for CH₂O₂ (Dioxirane)

using model chemistry: MP2=FULL/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: MP2=FULL/6-311G**

States and conformations

All results from a given calculation for CH₂O₂ (Dioxirane)