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	hartrees
Energy at 0K	-328.437445
Energy at 298.15K	-328.442978
HF Energy	-327.737405
Nuclear repulsion energy	265.709594

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3188	3092
2	A₁	3169	3073
3	A₁	3144	3049
4	A₁	1602	1554
5	A₁	1527	1481
6	A₁	1278	1239
7	A₁	1211	1174
8	A₁	1040	1008
9	A₁	1008	977
10	A₁	817	792
11	A₁	530	514
12	A₂	939	911
13	A₂	835	810
14	A₂	425	412
15	B₁	927	899
16	B₁	893	866
17	B₁	757	734
18	B₁	674	653
19	B₁	506	491
20	B₁	241	234
21	B₂	3185	3089
22	B₂	3155	3060
23	B₂	1581	1533
24	B₂	1483	1439
25	B₂	1356	1315
26	B₂	1263	1224
27	B₂	1203	1167
28	B₂	1084	1051
29	B₂	644	624
30	B₂	384	372

Atom	y (Å)	z (Å)
F1	0.000	2.330
C2	0.000	0.943
C3	1.223	0.256
C4	-1.223	0.256
C5	1.220	-1.153
C6	-1.220	-1.153
C7	0.000	-1.862
H8	2.152	0.822
H9	-2.152	0.822
H10	2.167	-1.693
H11	-2.167	-1.693
H12	0.000	-2.952

	F1	C2	C3	C4	C5	C6	C7	H8	H9	H10	H11	H12
F1		1.3878	2.4077	2.4077	3.6911	3.6911	4.1920	2.6287	2.6287	4.5702	4.5702	5.2820
C2	1.3878		1.4021	1.4021	2.4251	2.4251	2.8042	2.1559	2.1559	3.4125	3.4125	3.8942
C3	2.4077	1.4021		2.4451	1.4092	2.8203	2.4453	1.0883	3.4221	2.1662	3.9105	3.4329
C4	2.4077	1.4021	2.4451		2.8203	1.4092	2.4453	3.4221	1.0883	3.9105	2.1662	3.4329
C5	3.6911	2.4251	1.4092	2.8203		2.4408	1.4112	2.1835	3.9084	1.0902	3.4306	2.1735
C6	3.6911	2.4251	2.8203	1.4092	2.4408		1.4112	3.9084	2.1835	3.4306	1.0902	2.1735
C7	4.1920	2.8042	2.4453	2.4453	1.4112	1.4112		3.4398	3.4398	2.1740	2.1740	1.0900
H8	2.6287	2.1559	1.0883	3.4221	2.1835	3.9084	3.4398		4.3049	2.5147	4.9985	4.3440
H9	2.6287	2.1559	3.4221	1.0883	3.9084	2.1835	3.4398	4.3049		4.9985	2.5147	4.3440
H10	4.5702	3.4125	2.1662	3.9105	1.0902	3.4306	2.1740	2.5147	4.9985		4.3349	2.5063
H11	4.5702	3.4125	3.9105	2.1662	3.4306	1.0902	2.1740	4.9985	2.5147	4.3349		2.5063
H12	5.2820	3.8942	3.4329	3.4329	2.1735	2.1735	1.0900	4.3440	4.3440	2.5063	2.5063

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F1	C2	C3	119.313	F1	C2	C4	119.313
C2	C3	C5	119.226	C2	C3	H8	119.387
C2	C4	C6	119.226	C2	C4	H9	119.387
C3	C2	C4	121.373	C3	C5	C7	120.225
C3	C5	H10	119.608	C4	C6	C7	120.225
C4	C6	H11	119.608	C5	C3	H8	121.386
C5	C7	C6	119.724	C5	C7	H12	120.138
C6	C4	H9	121.386	C6	C7	H12	120.138
C7	C5	H10	120.167	C7	C6	H11	120.167

All results from a given calculation for C₆H₅F (Fluorobenzene)

using model chemistry: MP4/3-21G

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: MP4/3-21G

States and conformations

All results from a given calculation for C₆H₅F (Fluorobenzene)