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	hartrees
Energy at 0K
Energy at 298.15K	0.083238
HF Energy	0.083238
Nuclear repulsion energy	47.399736

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2829	3006	21.16
2	A₁	1917	2037	7.82
3	A₁	1126	1196	27.70
4	A₁	951	1011	25.30
5	A₂	692	735	0.00
6	B₁	858	911	103.00
7	B₂	2783	2957	453.47
8	B₂	979	1040	0.76
9	B₂	358	381	44.33

Atom	y (Å)	z (Å)
O1	0.000	0.873
C2	0.650	-0.461
C3	-0.650	-0.461
H4	1.660	-0.724
H5	-1.660	-0.724

	O1	C2	C3	H4	H5
O1		1.4838	1.4838	2.3027	2.3027
C2	1.4838		1.2998	1.0432	2.3244
C3	1.4838	1.2998		2.3244	1.0432
H4	2.3027	1.0432	2.3244		3.3192
H5	2.3027	2.3244	1.0432	3.3192

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	64.023	O1	C2	H4	130.544
O1	C3	C2	64.023	O1	C3	H5	130.544
C2	O1	C3	51.954	C2	C3	H5	165.433
C3	C2	H4	165.433

All results from a given calculation for C₂H₂O (Oxirene)

using model chemistry: PM6

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: PM6

States and conformations

All results from a given calculation for C₂H₂O (Oxirene)