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	hartrees
Energy at 0K	-216.492475
Energy at 298.15K
HF Energy	-215.916357
Nuclear repulsion energy	116.421525

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3318	3114	6.43
2	A'	3233	3034	5.19
3	A'	3213	3016	9.24
4	A'	3094	2904	35.50
5	A'	1774	1665	1.67
6	A'	1574	1477	1.05
7	A'	1496	1404	9.09
8	A'	1472	1381	14.59
9	A'	1352	1269	0.30
10	A'	1181	1109	45.85
11	A'	1050	985	30.78
12	A'	946	888	2.46
13	A'	619	581	5.78
14	A'	284	267	3.11
15	A"	3137	2944	37.38
16	A"	1294	1215	0.07
17	A"	1086	1019	12.66
18	A"	1033	969	16.00
19	A"	949	890	38.71
20	A"	569	534	7.95
21	A"	166	156	3.34

Atom	x (Å)	y (Å)	z (Å)
C1	-0.951	-0.200	0.000
C2	0.000	0.959	0.000
C3	1.326	0.830	0.000
F4	-0.263	-1.407	0.000
H5	1.976	1.698	0.000
H6	1.798	-0.146	0.000
H7	-0.468	1.942	0.000
H8	-1.595	-0.179	0.888
H9	-1.595	-0.179	-0.888

	C1	C2	C3	F4	H5	H6	H7	H8	H9
C1		1.4989	2.4994	1.3893	3.4889	2.7493	2.1960	1.0969	1.0969
C2	1.4989		1.3326	2.3804	2.1101	2.1101	1.0892	2.1507	2.1507
C3	2.4994	1.3326		2.7445	1.0846	1.0840	2.1110	3.2155	3.2155
F4	1.3893	2.3804	2.7445		3.8289	2.4164	3.3557	2.0174	2.0174
H5	3.4889	2.1101	1.0846	3.8289		1.8531	2.4562	4.1309	4.1309
H6	2.7493	2.1101	1.0840	2.4164	1.8531		3.0813	3.5071	3.5071
H7	2.1960	1.0892	2.1110	3.3557	2.4562	3.0813		2.5607	2.5607
H8	1.0969	2.1507	3.2155	2.0174	4.1309	3.5071	2.5607		1.7755
H9	1.0969	2.1507	3.2155	2.0174	4.1309	3.5071	2.5607	1.7755

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	123.837	C1	C2	H7	115.185
C2	C1	F4	110.959	C2	C1	H8	110.944
C2	C1	H9	110.944	C2	C3	H5	121.266
C2	C3	H6	121.320	C3	C2	H7	120.978
F4	C1	H8	107.900	F4	C1	H9	107.900
H5	C3	H6	117.414

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

using model chemistry: MP3/6-31G*

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: MP3/6-31G*

States and conformations

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