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	hartrees
Energy at 0K	-216.691335
Energy at 298.15K
HF Energy	-216.000499
Nuclear repulsion energy	116.026514

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3275	3154
2	A'	3184	3066
3	A'	3168	3050
4	A'	3056	2943
5	A'	1694	1632
6	A'	1524	1467
7	A'	1462	1408
8	A'	1440	1386
9	A'	1316	1267
10	A'	1130	1088
11	A'	1006	969
12	A'	910	876
13	A'	606	584
14	A'	269	259
15	A"	3104	2988
16	A"	1268	1221
17	A"	1053	1014
18	A"	993	956
19	A"	844	812
20	A"	535	515
21	A"	148	143

Atom	x (Å)	y (Å)	z (Å)
C1	-0.949	-0.203	0.000
C2	0.000	0.959	0.000
C3	1.332	0.847	0.000
F4	-0.269	-1.421	0.000
H5	1.963	1.727	0.000
H6	1.814	-0.123	0.000
H7	-0.478	1.936	0.000
H8	-1.587	-0.182	0.890
H9	-1.587	-0.182	-0.890

	C1	C2	C3	F4	H5	H6	H7	H8	H9
C1		1.5002	2.5113	1.3949	3.4941	2.7647	2.1904	1.0951	1.0951
C2	1.5002		1.3368	2.3952	2.1084	2.1123	1.0881	2.1472	2.1472
C3	2.5113	1.3368		2.7766	1.0832	1.0830	2.1127	3.2202	3.2202
F4	1.3949	2.3952	2.7766		3.8598	2.4553	3.3638	2.0159	2.0159
H5	3.4941	2.1084	1.0832	3.8598		1.8559	2.4506	4.1278	4.1278
H6	2.7647	2.1123	1.0830	2.4553	1.8559		3.0814	3.5161	3.5161
H7	2.1904	1.0881	2.1127	3.3638	2.4506	3.0814		2.5506	2.5506
H8	1.0951	2.1472	3.2202	2.0159	4.1278	3.5161	2.5506		1.7802
H9	1.0951	2.1472	3.2202	2.0159	4.1278	3.5161	2.5506	1.7802

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	124.449	C1	C2	H7	114.680
C2	C1	F4	111.595	C2	C1	H8	110.680
C2	C1	H9	110.680	C2	C3	H5	120.851
C2	C3	H6	121.241	C3	C2	H7	120.871
F4	C1	H8	107.505	F4	C1	H9	107.505
H5	C3	H6	117.907

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

using model chemistry: MP4/TZVP

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: MP4/TZVP

States and conformations

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