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	hartrees
Energy at 0K	-229.348281
Energy at 298.15K	-229.353015
HF Energy	-228.623518
Nuclear repulsion energy	160.953641

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3352	3146	0.01
2	A₁	3323	3118	0.49
3	A₁	1583	1485	23.16
4	A₁	1471	1380	4.39
5	A₁	1203	1129	0.30
6	A₁	1124	1054	17.50
7	A₁	1051	986	40.10
8	A₁	902	846	16.47
9	A₂	808	758	0.00
10	A₂	731	686	0.00
11	A₂	587	551	0.00
12	B₁	827	776	0.08
13	B₁	767	720	91.56
14	B₁	622	583	25.94
15	B₂	3347	3140	2.12
16	B₂	3312	3108	1.98
17	B₂	1667	1564	0.18
18	B₂	1331	1249	3.79
19	B₂	1278	1199	28.09
20	B₂	1106	1038	0.50
21	B₂	905	849	0.30

Atom	y (Å)	z (Å)
O1	0.000	1.162
C2	1.089	0.348
C3	-1.089	0.348
C4	0.720	-0.960
C5	-0.720	-0.960
H6	2.048	0.845
H7	-2.048	0.845
H8	1.376	-1.819
H9	-1.376	-1.819

	O1	C2	C3	C4	C5	H6	H7	H8	H9
O1		1.3598	1.3598	2.2406	2.2406	2.0721	2.0721	3.2831	3.2831
C2	1.3598		2.1781	1.3585	2.2323	1.0798	3.1759	2.1854	3.2819
C3	1.3598	2.1781		2.2323	1.3585	3.1759	1.0798	3.2819	2.1854
C4	2.2406	1.3585	2.2323		1.4405	2.2401	3.3042	1.0808	2.2656
C5	2.2406	2.2323	1.3585	1.4405		3.3042	2.2401	2.2656	1.0808
H6	2.0721	1.0798	3.1759	2.2401	3.3042		4.0954	2.7468	4.3378
H7	2.0721	3.1759	1.0798	3.3042	2.2401	4.0954		4.3378	2.7468
H8	3.2831	2.1854	3.2819	1.0808	2.2656	2.7468	4.3378		2.7524
H9	3.2831	3.2819	2.1854	2.2656	1.0808	4.3378	2.7468	2.7524

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C4	111.031	O1	C2	H6	115.817
O1	C3	C5	111.031	O1	C3	H7	115.817
C2	O1	C3	106.434	C2	C4	C5	105.752
C2	C4	H8	126.881	C3	C5	C4	105.752
C3	C5	H9	126.881	C4	C2	H6	133.152
C4	C5	H9	127.367	C5	C3	H7	133.152
C5	C4	H8	127.367

All results from a given calculation for C₄H₄O (Furan)

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 C4H4O (Furan)

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

States and conformations

All results from a given calculation for C₄H₄O (Furan)