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	hartrees
Energy at 0K	-41.006701
Energy at 298.15K	-41.014197
Nuclear repulsion energy	93.389896

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3388	3092	14.93
2	A₁	3186	2907	14.35
3	A₁	1791	1634	0.01
4	A₁	1667	1521	1.22
5	A₁	1507	1375	4.33
6	A₁	1216	1109	1.52
7	A₁	1048	956	16.22
8	A₁	958	874	24.59
9	A₁	796	727	8.78
10	A₂	3232	2949	0.00
11	A₂	1299	1186	0.00
12	A₂	1173	1070	0.00
13	A₂	1065	972	0.00
14	A₂	429	391	0.00
15	B₁	3237	2954	122.86
16	B₁	1269	1158	4.70
17	B₁	1135	1036	34.87
18	B₁	771	704	58.71
19	B₁	154	140	19.47
20	B₂	3356	3062	4.68
21	B₂	3180	2902	148.84
22	B₂	1658	1513	0.42
23	B₂	1485	1355	2.57
24	B₂	1446	1319	0.33
25	B₂	1198	1093	114.97
26	B₂	991	904	0.32
27	B₂	872	796	2.02

Atom	x (Å)	y (Å)	z (Å)
O1	0.000	0.000	1.193
C2	0.000	1.199	0.373
C3	0.000	0.667	-1.050
C4	0.000	-0.667	-1.050
C5	0.000	-1.199	0.373
H6	0.883	1.786	0.604
H7	-0.883	1.786	0.604
H8	-0.883	-1.786	0.604
H9	0.883	-1.786	0.604
H10	0.000	1.306	-1.912
H11	0.000	-1.306	-1.912

	O1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11
O1		1.4526	2.3399	2.3399	1.4526	2.0775	2.0775	2.0775	2.0775	3.3682	3.3682
C2	1.4526		1.5190	2.3465	2.3980	1.0852	1.0852	3.1216	3.1216	2.2870	3.3906
C3	2.3399	1.5190		1.3339	2.3465	2.1838	2.1838	3.0878	3.0878	1.0731	2.1533
C4	2.3399	2.3465	1.3339		1.5190	3.0878	3.0878	2.1838	2.1838	2.1533	1.0731
C5	1.4526	2.3980	2.3465	1.5190		3.1216	3.1216	1.0852	1.0852	3.3906	2.2870
H6	2.0775	1.0852	2.1838	3.0878	3.1216		1.7655	3.9849	3.5725	2.7092	4.0834
H7	2.0775	1.0852	2.1838	3.0878	3.1216	1.7655		3.5725	3.9849	2.7092	4.0834
H8	2.0775	3.1216	3.0878	2.1838	1.0852	3.9849	3.5725		1.7655	4.0834	2.7092
H9	2.0775	3.1216	3.0878	2.1838	1.0852	3.5725	3.9849	1.7655		4.0834	2.7092
H10	3.3682	2.2870	1.0731	2.1533	3.3906	2.7092	2.7092	4.0834	4.0834		2.6129
H11	3.3682	3.3906	2.1533	1.0731	2.2870	4.0834	4.0834	2.7092	2.7092	2.6129

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	103.868	O1	C2	H6	109.035
O1	C2	H7	109.035	O1	C5	C4	103.868
O1	C5	H8	109.035	O1	C5	H9	109.035
C2	O1	C5	111.258	C2	C3	C4	110.503
C2	C3	H10	122.915	C3	C2	H6	112.919
C3	C2	H7	112.919	C3	C4	C5	110.503
C3	C4	H11	126.581	C4	C3	H10	126.581
C4	C5	H8	112.919	C4	C5	H9	112.919
C5	C4	H11	122.915	H6	C2	H7	108.862
H8	C5	H9	108.862

All results from a given calculation for C₄H₆O (Furan, 2,5-dihydro-)

using model chemistry: HF/CEP-121G

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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Number	Element	Mulliken
1	O	-0.442
2	C	-0.127
3	C	-0.140
4	C	-0.140
5	C	-0.127
6	H	0.146
7	H	0.146
8	H	0.146
9	H	0.146
10	H	0.196
11	H	0.196

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C4H6O (Furan, 2,5-dihydro-)

using model chemistry: HF/CEP-121G

States and conformations

All results from a given calculation for C₄H₆O (Furan, 2,5-dihydro-)