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	hartrees
Energy at 0K	-217.885951
Energy at 298.15K	-217.893859
HF Energy	-217.179685
Nuclear repulsion energy	132.507659

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3147	3003	36.97
2	A'	3142	2998	53.41
3	A'	3075	2934	26.55
4	A'	3061	2920	10.53
5	A'	1531	1461	5.03
6	A'	1514	1444	5.04
7	A'	1447	1381	22.59
8	A'	1415	1350	10.12
9	A'	1224	1167	10.54
10	A'	1189	1134	43.89
11	A'	988	943	39.34
12	A'	843	804	9.53
13	A'	482	460	3.57
14	A'	354	338	0.55
15	A'	269	256	0.19
16	A"	3144	3000	18.86
17	A"	3134	2990	0.00
18	A"	3056	2916	14.79
19	A"	1508	1439	0.00
20	A"	1503	1434	0.03
21	A"	1447	1380	28.72
22	A"	1396	1332	2.31
23	A"	1188	1133	11.19
24	A"	956	913	0.00
25	A"	946	903	0.10
26	A"	417	398	7.47
27	A"	215	205	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.280	0.246	0.000
F2	-0.871	1.038	0.000
H3	1.132	0.938	0.000
C4	0.280	-0.584	1.273
C5	0.280	-0.584	-1.273
H6	1.192	-1.190	1.332
H7	1.192	-1.190	-1.332
H8	0.232	0.067	2.151
H9	0.232	0.067	-2.151
H10	-0.589	-1.252	1.283
H11	-0.589	-1.252	-1.283

	C1	F2	H3	C4	C5	H6	H7	H8	H9	H10	H11
C1		1.3977	1.0972	1.5197	1.5197	2.1606	2.1606	2.1588	2.1588	2.1551	2.1551
F2	1.3977		2.0062	2.3621	2.3621	3.3161	3.3161	2.6052	2.6052	2.6399	2.6399
H3	1.0972	2.0062		2.1592	2.1592	2.5110	2.5110	2.4888	2.4888	3.0660	3.0660
C4	1.5197	2.3621	2.1592		2.5451	1.0960	2.8248	1.0945	3.4851	1.0957	2.7802
C5	1.5197	2.3621	2.1592	2.5451		2.8248	1.0960	3.4851	1.0945	2.7802	1.0957
H6	2.1606	3.3161	2.5110	1.0960	2.8248		2.6632	1.7813	3.8248	1.7823	3.1636
H7	2.1606	3.3161	2.5110	2.8248	1.0960	2.6632		3.8248	1.7813	3.1636	1.7823
H8	2.1588	2.6052	2.4888	1.0945	3.4851	1.7813	3.8248		4.3015	1.7795	3.7684
H9	2.1588	2.6052	2.4888	3.4851	1.0945	3.8248	1.7813	4.3015		3.7684	1.7795
H10	2.1551	2.6399	3.0660	1.0957	2.7802	1.7823	3.1636	1.7795	3.7684		2.5653
H11	2.1551	2.6399	3.0660	2.7802	1.0957	3.1636	1.7823	3.7684	1.7795	2.5653

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H8	110.271	C1	C4	H10	109.909
C1	C5	H7	110.325	C1	C5	H9	110.271
C1	C5	H11	109.909	F2	C1	H3	106.425
F2	C1	C4	108.047	F2	C1	C5	108.047
H3	C1	C4	110.147	H3	C1	C5	110.147
C4	C1	C5	113.724	H7	C5	H9	108.809
H7	C5	H11	108.814	H8	C4	H10	108.672
H9	C5	H11	108.672

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

using model chemistry: QCISD/6-311G**

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: QCISD/6-311G**

States and conformations

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