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	hartrees
Energy at 0K	-330.539906
Energy at 298.15K	-330.545086
HF Energy	-329.573707
Nuclear repulsion energy	268.351234

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3289	3093	0.32
2	A₁	3278	3083	13.15
3	A₁	3257	3063	0.07
4	A₁	1664	1565	46.74
5	A₁	1545	1453	75.26
6	A₁	1254	1180	95.14
7	A₁	1194	1123	16.02
8	A₁	1051	989	6.67
9	A₁	1023	963	0.27
10	A₁	821	772	27.55
11	A₁	520	489	5.05
12	A₂	899	846	0.00
13	A₂	808	760	0.00
14	A₂	393	370	0.00
15	B₁	887	835	0.69
16	B₁	850	799	2.63
17	B₁	736	693	116.34
18	B₁	487	458	8.92
19	B₁	351	331	0.80
20	B₁	221	208	0.02
21	B₂	3287	3092	3.09
22	B₂	3266	3072	8.38
23	B₂	1673	1574	5.96
24	B₂	1504	1415	0.99
25	B₂	1469	1381	0.18
26	B₂	1345	1265	0.58
27	B₂	1200	1129	0.11
28	B₂	1105	1040	7.54
29	B₂	623	586	0.15
30	B₂	401	377	2.54

Atom	y (Å)	z (Å)
F1	0.000	2.292
C2	0.000	0.924
C3	1.221	0.261
C4	-1.221	0.261
C5	1.211	-1.138
C6	-1.211	-1.138
C7	0.000	-1.838
H8	2.142	0.828
H9	-2.142	0.828
H10	2.150	-1.676
H11	-2.150	-1.676
H12	0.000	-2.921

	F1	C2	C3	C4	C5	C6	C7	H8	H9	H10	H11	H12
F1		1.3683	2.3704	2.3704	3.6375	3.6375	4.1304	2.5947	2.5947	4.5135	4.5135	5.2128
C2	1.3683		1.3898	1.3898	2.3910	2.3910	2.7621	2.1444	2.1444	3.3740	3.3740	3.8445
C3	2.3704	1.3898		2.4428	1.3986	2.8057	2.4284	1.0817	3.4112	2.1481	3.8884	3.4077
C4	2.3704	1.3898	2.4428		2.8057	1.3986	2.4284	3.4112	1.0817	3.8884	2.1481	3.4077
C5	3.6375	2.3910	1.3986	2.8057		2.4217	1.3988	2.1755	3.8870	1.0827	3.4039	2.1551
C6	3.6375	2.3910	2.8057	1.3986	2.4217		1.3988	3.8870	2.1755	3.4039	1.0827	2.1551
C7	4.1304	2.7621	2.4284	2.4284	1.3988	1.3988		3.4204	3.4204	2.1563	2.1563	1.0824
H8	2.5947	2.1444	1.0817	3.4112	2.1755	3.8870	3.4204		4.2845	2.5045	4.9697	4.3177
H9	2.5947	2.1444	3.4112	1.0817	3.8870	2.1755	3.4204	4.2845		4.9697	2.5045	4.3177
H10	4.5135	3.3740	2.1481	3.8884	1.0827	3.4039	2.1563	2.5045	4.9697		4.3005	2.4844
H11	4.5135	3.3740	3.8884	2.1481	3.4039	1.0827	2.1563	4.9697	2.5045	4.3005		2.4844
H12	5.2128	3.8445	3.4077	3.4077	2.1551	2.1551	1.0824	4.3177	4.3177	2.4844	2.4844

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F1	C2	C3	118.500	F1	C2	C4	118.500
C2	C3	C5	118.068	C2	C3	H8	119.855
C2	C4	C6	118.068	C2	C4	H9	119.855
C3	C2	C4	123.000	C3	C5	C7	120.477
C3	C5	H10	119.385	C4	C6	C7	120.477
C4	C6	H11	119.385	C5	C3	H8	122.078
C5	C7	C6	119.911	C5	C7	H12	120.045
C6	C4	H9	122.078	C6	C7	H12	120.045
C7	C5	H10	120.138	C7	C6	H11	120.138

All results from a given calculation for C₆H₅F (Fluorobenzene)

using model chemistry: MP2/6-31+G**

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 C6H5F (Fluorobenzene)

using model chemistry: MP2/6-31+G**

States and conformations

All results from a given calculation for C₆H₅F (Fluorobenzene)