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	hartrees
Energy at 0K	-217.724238
Energy at 298.15K	-217.732162
HF Energy	-217.117811
Nuclear repulsion energy	132.407045

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3166	2990	30.57
2	A'	3160	2984	46.05
3	A'	3080	2909	4.23
4	A'	3076	2905	37.37
5	A'	1560	1473	6.32
6	A'	1543	1457	4.63
7	A'	1472	1390	18.40
8	A'	1425	1345	18.58
9	A'	1242	1172	9.71
10	A'	1201	1134	43.12
11	A'	998	942	34.25
12	A'	853	806	8.48
13	A'	486	459	3.34
14	A'	358	338	0.94
15	A'	273	257	0.15
16	A"	3164	2988	16.11
17	A"	3153	2978	0.05
18	A"	3076	2905	12.66
19	A"	1537	1451	0.05
20	A"	1533	1447	0.03
21	A"	1472	1390	29.99
22	A"	1424	1345	1.75
23	A"	1204	1137	10.40
24	A"	977	923	0.01
25	A"	957	903	0.51
26	A"	412	390	7.14
27	A"	231	218	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.285	0.245	0.000
F2	-0.883	1.031	0.000
H3	1.131	0.947	0.000
C4	0.285	-0.581	1.272
C5	0.285	-0.581	-1.272
H6	1.197	-1.185	1.341
H7	1.197	-1.185	-1.341
H8	0.229	0.073	2.149
H9	0.229	0.073	-2.149
H10	-0.582	-1.251	1.281
H11	-0.582	-1.251	-1.281

	C1	F2	H3	C4	C5	H6	H7	H8	H9	H10	H11
C1		1.4074	1.0989	1.5165	1.5165	2.1624	2.1624	2.1564	2.1564	2.1521	2.1521
F2	1.4074		2.0153	2.3617	2.3617	3.3218	3.3218	2.6019	2.6019	2.6339	2.6339
H3	1.0989	2.0153		2.1601	2.1601	2.5193	2.5193	2.4886	2.4886	3.0669	3.0669
C4	1.5165	2.3617	2.1601		2.5440	1.0966	2.8330	1.0953	3.4832	1.0963	2.7783
C5	1.5165	2.3617	2.1601	2.5440		2.8330	1.0966	3.4832	1.0953	2.7783	1.0963
H6	2.1624	3.3218	2.5193	1.0966	2.8330		2.6821	1.7814	3.8341	1.7820	3.1696
H7	2.1624	3.3218	2.5193	2.8330	1.0966	2.6821		3.8341	1.7814	3.1696	1.7820
H8	2.1564	2.6019	2.4886	1.0953	3.4832	1.7814	3.8341		4.2977	1.7794	3.7650
H9	2.1564	2.6019	2.4886	3.4832	1.0953	3.8341	1.7814	4.2977		3.7650	1.7794
H10	2.1521	2.6339	3.0669	1.0963	2.7783	1.7820	3.1696	1.7794	3.7650		2.5617
H11	2.1521	2.6339	3.0669	2.7783	1.0963	3.1696	1.7820	3.7650	1.7794	2.5617

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H8	110.268	C1	C4	H10	109.865
C1	C5	H7	110.661	C1	C5	H9	110.268
C1	C5	H11	109.865	F2	C1	H3	106.394
F2	C1	C4	107.690	F2	C1	C5	107.690
H3	C1	C4	110.344	H3	C1	C5	110.344
C4	C1	C5	114.024	H7	C5	H9	108.727
H7	C5	H11	108.704	H8	C4	H10	108.567
H9	C5	H11	108.567

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

using model chemistry: CCSD/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 CH3CHFCH3 (2-Fluoropropane)

using model chemistry: CCSD/6-31G*

States and conformations

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