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	hartrees
Energy at 0K	-151.830800
Energy at 298.15K
HF Energy	-151.507218
Nuclear repulsion energy	59.146914

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3443	3443	3.61
2	A₁	1778	1778	1.11
3	A₁	1025	1025	0.10
4	A₁	839	839	26.97
5	A₂	533	533	0.00
6	B₁	552	552	113.91
7	B₂	3374	3374	28.98
8	B₂	965	965	12.34
9	B₂	391	391	0.05

Atom	y (Å)	z (Å)
O1	0.000	0.953
C2	0.643	-0.493
C3	-0.643	-0.493
H4	1.655	-0.853
H5	-1.655	-0.853

	O1	C2	C3	H4	H5
O1		1.5833	1.5833	2.4499	2.4499
C2	1.5833		1.2870	1.0737	2.3266
C3	1.5833	1.2870		2.3266	1.0737
H4	2.4499	1.0737	2.3266		3.3104
H5	2.4499	2.3266	1.0737	3.3104

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	66.020	O1	C2	H4	133.543
O1	C3	C2	66.020	O1	C3	H5	133.543
C2	O1	C3	47.960	C2	C3	H5	160.437
C3	C2	H4	160.437

All results from a given calculation for C₂H₂O (Oxirene)

using model chemistry: MP3=FULL/6-31G

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: MP3=FULL/6-31G

States and conformations

All results from a given calculation for C₂H₂O (Oxirene)