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	hartrees
Energy at 0K	-152.109644
Energy at 298.15K
HF Energy	-151.620973
Nuclear repulsion energy	61.337749

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3434	3434	2.10
2	A₁	1797	1797	1.20
3	A₁	1103	1103	5.60
4	A₁	903	903	46.92
5	A₂	579	579	0.00
6	B₁	525	525	83.25
7	B₂	3362	3362	41.46
8	B₂	964	964	5.10
9	B₂	217	217	2.72

Atom	y (Å)	z (Å)
O1	0.000	0.891
C2	0.637	-0.462
C3	-0.637	-0.462
H4	1.658	-0.790
H5	-1.658	-0.790

	O1	C2	C3	H4	H5
O1		1.4955	1.4955	2.3603	2.3603
C2	1.4955		1.2737	1.0719	2.3176
C3	1.4955	1.2737		2.3176	1.0719
H4	2.3603	1.0719	2.3176		3.3150
H5	2.3603	2.3176	1.0719	3.3150

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	64.796	O1	C2	H4	132.981
O1	C3	C2	64.796	O1	C3	H5	132.981
C2	O1	C3	50.407	C2	C3	H5	162.222
C3	C2	H4	162.222

All results from a given calculation for C₂H₂O (Oxirene)

using model chemistry: CCSD/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 C2H2O (Oxirene)

using model chemistry: CCSD/6-311G**

States and conformations

All results from a given calculation for C₂H₂O (Oxirene)