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	hartrees
Energy at 0K	-218.045089
Energy at 298.15K	-218.052910
HF Energy	-217.199421
Nuclear repulsion energy	132.545172

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3135	2959
2	A'	3127	2951
3	A'	3047	2876
4	A'	3041	2870
5	A'	1518	1432
6	A'	1499	1415
7	A'	1418	1338
8	A'	1371	1294
9	A'	1201	1134
10	A'	1149	1084
11	A'	955	901
12	A'	825	779
13	A'	472	445
14	A'	348	329
15	A'	256	242
16	A"	3133	2956
17	A"	3120	2945
18	A"	3037	2867
19	A"	1495	1411
20	A"	1489	1405
21	A"	1417	1338
22	A"	1378	1301
23	A"	1171	1105
24	A"	940	887
25	A"	928	876
26	A"	405	382
27	A"	209	197

Atom	x (Å)	y (Å)	z (Å)
C1	0.283	0.245	0.000
F2	-0.879	1.038	0.000
H3	1.123	0.947	0.000
C4	0.283	-0.584	1.269
C5	0.283	-0.584	-1.269
H6	1.198	-1.178	1.330
H7	1.198	-1.178	-1.330
H8	0.228	0.063	2.147
H9	0.228	0.063	-2.147
H10	-0.575	-1.260	1.276
H11	-0.575	-1.260	-1.276

	C1	F2	H3	C4	C5	H6	H7	H8	H9	H10	H11
C1		1.4064	1.0955	1.5158	1.5158	2.1520	2.1520	2.1551	2.1551	2.1517	2.1517
F2	1.4064		2.0044	2.3643	2.3643	3.3154	3.3154	2.6049	2.6049	2.6460	2.6460
H3	1.0955	2.0044		2.1591	2.1591	2.5081	2.5081	2.4883	2.4883	3.0637	3.0637
C4	1.5158	2.3643	2.1591		2.5383	1.0930	2.8188	1.0912	3.4769	1.0926	2.7698
C5	1.5158	2.3643	2.1591	2.5383		2.8188	1.0930	3.4769	1.0912	2.7698	1.0926
H6	2.1520	3.3154	2.5081	1.0930	2.8188		2.6596	1.7738	3.8164	1.7761	3.1531
H7	2.1520	3.3154	2.5081	2.8188	1.0930	2.6596		3.8164	1.7738	3.1531	1.7761
H8	2.1551	2.6049	2.4883	1.0912	3.4769	1.7738	3.8164		4.2933	1.7759	3.7564
H9	2.1551	2.6049	2.4883	3.4769	1.0912	3.8164	1.7738	4.2933		3.7564	1.7759
H10	2.1517	2.6460	3.0637	1.0926	2.7698	1.7761	3.1531	1.7759	3.7564		2.5520
H11	2.1517	2.6460	3.0637	2.7698	1.0926	3.1531	1.7761	3.7564	1.7759	2.5520

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H8	110.455	C1	C4	H10	110.104
C1	C5	H7	110.104	C1	C5	H9	110.455
C1	C5	H11	110.104	F2	C1	H3	105.813
F2	C1	C4	107.955	F2	C1	C5	107.955
H3	C1	C4	110.517	H3	C1	C5	110.517
C4	C1	C5	113.710	H7	C5	H9	108.602
H7	C5	H11	108.713	H8	C4	H10	108.818
H9	C5	H11	108.818

All results from a given calculation for CH₃CHFCH₃ (2-Fluoropropane)

using model chemistry: MP4/6-311+G(3df,2p)

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 CH3CHFCH3 (2-Fluoropropane)

using model chemistry: MP4/6-311+G(3df,2p)

States and conformations

All results from a given calculation for CH₃CHFCH₃ (2-Fluoropropane)