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	hartrees
Energy at 0K	-152.201988
Energy at 298.15K
HF Energy	-151.636761
Nuclear repulsion energy	61.114040

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3421	3271
2	A₁	1771	1693
3	A₁	1079	1032
4	A₁	873	834
5	A₂	434	414
6	B₁	465	445
7	B₂	3353	3206
8	B₂	959	917
9	B₂	49i	47i

Atom	y (Å)	z (Å)
O1	0.000	0.898
C2	0.637	-0.465
C3	-0.637	-0.465
H4	1.653	-0.801
H5	-1.653	-0.801

	O1	C2	C3	H4	H5
O1		1.5053	1.5053	2.3708	2.3708
C2	1.5053		1.2738	1.0701	2.3143
C3	1.5053	1.2738		2.3143	1.0701
H4	2.3708	1.0701	2.3143		3.3059
H5	2.3708	2.3143	1.0701	3.3059

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	64.970	O1	C2	H4	133.307
O1	C3	C2	64.970	O1	C3	H5	133.307
C2	O1	C3	50.060	C2	C3	H5	161.724
C3	C2	H4	161.724

All results from a given calculation for C₂H₂O (Oxirene)

using model chemistry: CCSD(T)=FULL/TZVP

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(T)=FULL/TZVP

States and conformations

All results from a given calculation for C₂H₂O (Oxirene)