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	hartrees
Energy at 0K	-38.118120
Energy at 298.15K	-38.120869
HF Energy	-37.788662
Nuclear repulsion energy	38.585620

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3135	3030	39.06
2	A₁	1529	1478	0.49
3	A₁	1114	1077	7.53
4	A₁	673	650	0.39
5	A₂	963	931	0.00
6	B₁	3276	3166	47.06
7	B₁	1127	1089	4.73
8	B₂	1244	1202	0.28
9	B₂	861	832	34.64

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.781
H2	0.946	0.000	1.343
H3	-0.946	0.000	1.343
O4	0.000	0.821	-0.461
O5	0.000	-0.821	-0.461

	C1	H2	H3	O4	O5
C1		1.0998	1.0998	1.4886	1.4886
H2	1.0998		1.8915	2.1954	2.1954
H3	1.0998	1.8915		2.1954	2.1954
O4	1.4886	2.1954	2.1954		1.6412
O5	1.4886	2.1954	2.1954	1.6412

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	O5	56.546	C1	O5	O4	56.546
H2	C1	H3	118.616	H2	C1	O4	115.205
H2	C1	O5	115.205	H3	C1	O4	115.205
H3	C1	O5	115.205	O4	C1	O5	66.907

All results from a given calculation for CH₂O₂ (Dioxirane)

using model chemistry: MP2/CEP-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: MP2/CEP-31G

States and conformations

All results from a given calculation for CH₂O₂ (Dioxirane)