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	hartrees
Energy at 0K	-152.248651
Energy at 298.15K
HF Energy	-151.645581
Nuclear repulsion energy	61.121679

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3392	3392
2	A₁	1755	1755
3	A₁	1061	1061
4	A₁	870	870
5	A₂	581	581
6	B₁	503	503
7	B₂	3322	3322
8	B₂	957	957
9	B₂	145	145

Atom	y (Å)	z (Å)
O1	0.000	0.897
C2	0.638	-0.465
C3	-0.638	-0.465
H4	1.656	-0.796
H5	-1.656	-0.796

	O1	C2	C3	H4	H5
O1		1.5039	1.5039	2.3681	2.3681
C2	1.5039		1.2755	1.0708	2.3176
C3	1.5039	1.2755		2.3176	1.0708
H4	2.3681	1.0708	2.3176		3.3123
H5	2.3681	2.3176	1.0708	3.3123

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	64.909	O1	C2	H4	133.082
O1	C3	C2	64.909	O1	C3	H5	133.082
C2	O1	C3	50.183	C2	C3	H5	162.009
C3	C2	H4	162.009

All results from a given calculation for C₂H₂O (Oxirene)

using model chemistry: QCISD(T)/daug-cc-pVTZ

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: QCISD(T)/daug-cc-pVTZ

States and conformations

All results from a given calculation for C₂H₂O (Oxirene)