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	hartrees
Energy at 0K	-229.221815
Energy at 298.15K	-229.226692
HF Energy	-228.624732
Nuclear repulsion energy	161.823316

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3418	3157	0.01
2	A₁	3386	3128	0.60
3	A₁	1626	1502	25.92
4	A₁	1509	1394	3.52
5	A₁	1233	1139	0.60
6	A₁	1148	1060	23.42
7	A₁	1075	993	39.20
8	A₁	923	853	17.51
9	A₂	891	823	0.00
10	A₂	787	727	0.00
11	A₂	624	576	0.00
12	B₁	896	827	0.12
13	B₁	809	748	91.70
14	B₁	642	593	28.97
15	B₂	3412	3152	2.43
16	B₂	3374	3117	2.56
17	B₂	1714	1583	0.83
18	B₂	1364	1260	1.91
19	B₂	1304	1205	26.00
20	B₂	1135	1049	0.47
21	B₂	927	856	0.44

Atom	y (Å)	z (Å)
O1	0.000	1.152
C2	1.086	0.345
C3	-1.086	0.345
C4	0.717	-0.952
C5	-0.717	-0.952
H6	2.039	0.840
H7	-2.039	0.840
H8	1.371	-1.805
H9	-1.371	-1.805

	O1	C2	C3	C4	C5	H6	H7	H8	H9
O1		1.3535	1.3535	2.2226	2.2226	2.0623	2.0623	3.2596	3.2596
C2	1.3535		2.1725	1.3479	2.2209	1.0736	3.1639	2.1685	3.2650
C3	1.3535	2.1725		2.2209	1.3479	3.1639	1.0736	3.2650	2.1685
C4	2.2226	1.3479	2.2209		1.4341	2.2267	3.2871	1.0753	2.2559
C5	2.2226	2.2209	1.3479	1.4341		3.2871	2.2267	2.2559	1.0753
H6	2.0623	1.0736	3.1639	2.2267	3.2871		4.0772	2.7283	4.3157
H7	2.0623	3.1639	1.0736	3.2871	2.2267	4.0772		4.3157	2.7283
H8	3.2596	2.1685	3.2650	1.0753	2.2559	2.7283	4.3157		2.7425
H9	3.2596	3.2650	2.1685	2.2559	1.0753	4.3157	2.7283	2.7425

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C4	110.727	O1	C2	H6	115.875
O1	C3	C5	110.727	O1	C3	H7	115.875
C2	O1	C3	106.750	C2	C4	C5	105.898
C2	C4	H8	126.625	C3	C5	C4	105.898
C3	C5	H9	126.625	C4	C2	H6	133.398
C4	C5	H9	127.477	C5	C3	H7	133.398
C5	C4	H8	127.477

All results from a given calculation for C₄H₄O (Furan)

using model chemistry: CID/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 C4H4O (Furan)

using model chemistry: CID/6-31G*

States and conformations

All results from a given calculation for C₄H₄O (Furan)