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	hartrees
Energy at 0K	-153.500676
Energy at 298.15K	-153.505356
Nuclear repulsion energy	74.742245

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3117	3020
2	A₁	1546	1498
3	A₁	1300	1260
4	A₁	1155	1119
5	A₁	898	870
6	A₂	3199	3099
7	A₂	1168	1131
8	A₂	1039	1007
9	B₁	3214	3114
10	B₁	1165	1129
11	B₁	814	789
12	B₂	3107	3010
13	B₂	1499	1452
14	B₂	1140	1104
15	B₂	848	822

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	0.857
C2	0.000	0.739	-0.372
C3	0.000	-0.739	-0.372
H4	0.930	1.278	-0.599
H5	-0.930	1.278	-0.599
H6	-0.930	-1.278	-0.599
H7	0.930	-1.278	-0.599

	O1	C2	C3	H4	H5	H6	H7
O1		1.4345	1.4345	2.1494	2.1494	2.1494	2.1494
C2	1.4345		1.4785	1.0984	1.0984	2.2331	2.2331
C3	1.4345	1.4785		2.2331	2.2331	1.0984	1.0984
H4	2.1494	1.0984	2.2331		1.8593	3.1614	2.5568
H5	2.1494	1.0984	2.2331	1.8593		2.5568	3.1614
H6	2.1494	2.2331	1.0984	3.1614	2.5568		1.8593
H7	2.1494	2.2331	1.0984	2.5568	3.1614	1.8593

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	58.980	O1	C2	H4	115.477
O1	C2	H5	115.477	O1	C3	C2	58.980
O1	C3	H6	115.477	O1	C3	H7	115.477
C2	O1	C3	62.040	C2	C3	H6	119.395
C2	C3	H7	119.395	C3	C2	H4	119.395
C3	C2	H5	119.395	H4	C2	H5	115.636
H6	C3	H7	115.636

All results from a given calculation for C₂H₄O (Ethylene oxide)

using model chemistry: CCSD(T)=FULL/cc-pCVDZ

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 C2H4O (Ethylene oxide)

using model chemistry: CCSD(T)=FULL/cc-pCVDZ

States and conformations

All results from a given calculation for C₂H₄O (Ethylene oxide)