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	hartrees
Energy at 0K	-187.902980
Energy at 298.15K	-187.905780
HF Energy	-187.544456
Nuclear repulsion energy	69.188321

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3166	3021	8.91
2	A₁	1629	1555	1.82
3	A₁	1128	1077	1.18
4	A₁	767	733	1.99
5	A₂	982	937	0.00
6	B₁	3274	3125	34.48
7	B₁	1175	1121	4.64
8	B₂	1257	1200	0.63
9	B₂	828	791	11.84

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.781
H2	0.925	0.000	1.346
H3	-0.925	0.000	1.346
O4	0.000	0.807	-0.461
O5	0.000	-0.807	-0.461

	C1	H2	H3	O4	O5
C1		1.0839	1.0839	1.4809	1.4809
H2	1.0839		1.8499	2.1844	2.1844
H3	1.0839	1.8499		2.1844	2.1844
O4	1.4809	2.1844	2.1844		1.6137
O5	1.4809	2.1844	2.1844	1.6137

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O4	O5	56.987	C1	O5	O4	56.987
H2	C1	H3	117.147	H2	C1	O4	115.927
H2	C1	O5	115.927	H3	C1	O4	115.927
H3	C1	O5	115.927	O4	C1	O5	66.026

All results from a given calculation for CH₂O₂ (Dioxirane)

using model chemistry: MP2/3-21G

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: MP2/3-21G

States and conformations

All results from a given calculation for CH₂O₂ (Dioxirane)