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	hartrees
Energy at 0K	-216.811280
Energy at 298.15K
HF Energy	-216.002333
Nuclear repulsion energy	116.392003

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3259	3159
2	A'	3172	3074
3	A'	3157	3059
4	A'	3036	2943
5	A'	1692	1640
6	A'	1508	1462
7	A'	1450	1405
8	A'	1425	1381
9	A'	1306	1266
10	A'	1139	1104
11	A'	1009	978
12	A'	915	887
13	A'	604	586
14	A'	267	258
15	A"	3081	2986
16	A"	1274	1235
17	A"	1048	1016
18	A"	1013	981
19	A"	939	910
20	A"	556	539
21	A"	173	168

Atom	x (Å)	y (Å)	z (Å)
C1	-0.948	-0.203	0.000
C2	0.000	0.956	0.000
C3	1.331	0.838	0.000
F4	-0.270	-1.412	0.000
H5	1.967	1.713	0.000
H6	1.802	-0.136	0.000
H7	-0.469	1.936	0.000
H8	-1.588	-0.177	0.887
H9	-1.588	-0.177	-0.887

	C1	C2	C3	F4	H5	H6	H7	H8	H9
C1		1.4973	2.5053	1.3861	3.4884	2.7502	2.1916	1.0942	1.0942
C2	1.4973		1.3366	2.3837	2.1080	2.1072	1.0861	2.1431	2.1431
C3	2.5053	1.3366		2.7614	1.0820	1.0818	2.1090	3.2156	3.2156
F4	1.3861	2.3837	2.7614		3.8434	2.4329	3.3538	2.0126	2.0126
H5	3.4884	2.1080	1.0820	3.8434		1.8568	2.4469	4.1233	4.1233
H6	2.7502	2.1072	1.0818	2.4329	1.8568		3.0744	3.5044	3.5044
H7	2.1916	1.0861	2.1090	3.3538	2.4469	3.0744		2.5498	2.5498
H8	1.0942	2.1431	3.2156	2.0126	4.1233	3.5044	2.5498		1.7731
H9	1.0942	2.1431	3.2156	2.0126	4.1233	3.5044	2.5498	1.7731

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	124.176	C1	C2	H7	115.137
C2	C1	F4	111.462	C2	C1	H8	110.615
C2	C1	H9	110.615	C2	C3	H5	120.925
C2	C3	H6	120.866	C3	C2	H7	120.687
F4	C1	H8	107.892	F4	C1	H9	107.892
H5	C3	H6	118.210

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

using model chemistry: MP4/cc-pVTZ

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/cc-pVTZ

States and conformations

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