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	hartrees
Energy at 0K	-216.553034
Energy at 298.15K
HF Energy	-215.936627
Nuclear repulsion energy	116.198203

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3356	3122	5.83
2	A'	3264	3037	5.85
3	A'	3248	3022	9.80
4	A'	3139	2921	32.73
5	A'	1765	1642	2.86
6	A'	1560	1452	1.03
7	A'	1498	1394	6.34
8	A'	1461	1360	17.92
9	A'	1349	1256	0.37
10	A'	1166	1085	51.75
11	A'	1040	967	41.13
12	A'	938	873	3.68
13	A'	615	572	7.63
14	A'	272	253	3.24
15	A"	3189	2967	22.91
16	A"	1288	1198	0.02
17	A"	1074	999	18.01
18	A"	1025	953	19.91
19	A"	939	874	41.95
20	A"	557	518	11.88
21	A"	149	139	3.93

Atom	x (Å)	y (Å)	z (Å)
C1	-0.952	-0.200	0.000
C2	0.000	0.957	0.000
C3	1.330	0.843	0.000
F4	-0.266	-1.417	0.000
H5	1.961	1.719	0.000
H6	1.812	-0.123	0.000
H7	-0.471	1.934	0.000
H8	-1.587	-0.189	0.887
H9	-1.587	-0.189	-0.887

	C1	C2	C3	F4	H5	H6	H7	H8	H9
C1		1.4986	2.5091	1.3969	3.4881	2.7646	2.1871	1.0907	1.0907
C2	1.4986		1.3352	2.3893	2.1035	2.1094	1.0840	2.1492	2.1492
C3	2.5091	1.3352		2.7668	1.0796	1.0792	2.1061	3.2189	3.2189
F4	1.3969	2.3893	2.7668		3.8464	2.4477	3.3569	2.0096	2.0096
H5	3.4881	2.1035	1.0796	3.8464		1.8483	2.4415	4.1248	4.1248
H6	2.7646	2.1094	1.0792	2.4477	1.8483		3.0728	3.5130	3.5130
H7	2.1871	1.0840	2.1061	3.3569	2.4415	3.0728		2.5568	2.5568
H8	1.0907	2.1492	3.2189	2.0096	4.1248	3.5130	2.5568		1.7733
H9	1.0907	2.1492	3.2189	2.0096	4.1248	3.5130	2.5568	1.7733

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	124.507	C1	C2	H7	114.795
C2	C1	F4	111.165	C2	C1	H8	111.234
C2	C1	H9	111.234	C2	C3	H5	120.805
C2	C3	H6	121.420	C3	C2	H7	120.698
F4	C1	H8	107.126	F4	C1	H9	107.126
H5	C3	H6	117.775

All results from a given calculation for CH₂CHCH₂F (Allyl Fluoride)

using model chemistry: MP3/6-31+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 CH2CHCH2F (Allyl Fluoride)

using model chemistry: MP3/6-31+G**

States and conformations

All results from a given calculation for CH₂CHCH₂F (Allyl Fluoride)