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	hartrees
Energy at 0K	-217.926964
Energy at 298.15K	-217.934823
HF Energy	-217.202425
Nuclear repulsion energy	132.417697

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3143	3026
2	A'	3135	3017
3	A'	3068	2953
4	A'	3053	2939
5	A'	1521	1464
6	A'	1507	1450
7	A'	1442	1388
8	A'	1401	1348
9	A'	1219	1174
10	A'	1169	1125
11	A'	969	932
12	A'	830	799
13	A'	480	462
14	A'	353	340
15	A'	264	254
16	A"	3140	3023
17	A"	3127	3010
18	A"	3049	2935
19	A"	1498	1442
20	A"	1495	1439
21	A"	1436	1382
22	A"	1392	1340
23	A"	1178	1134
24	A"	954	918
25	A"	944	908
26	A"	413	397
27	A"	200	193

Atom	x (Å)	y (Å)	z (Å)
C1	0.281	0.244	0.000
F2	-0.876	1.045	0.000
H3	1.129	0.936	0.000
C4	0.281	-0.586	1.270
C5	0.281	-0.586	-1.270
H6	1.194	-1.186	1.323
H7	1.194	-1.186	-1.323
H8	0.235	0.061	2.149
H9	0.235	0.061	-2.149
H10	-0.582	-1.257	1.281
H11	-0.582	-1.257	-1.281

	C1	F2	H3	C4	C5	H6	H7	H8	H9	H10	H11
C1		1.4071	1.0952	1.5171	1.5171	2.1516	2.1516	2.1570	2.1570	2.1537	2.1537
F2	1.4071		2.0078	2.3689	2.3689	3.3187	3.3187	2.6116	2.6116	2.6507	2.6507
H3	1.0952	2.0078		2.1566	2.1566	2.5022	2.5022	2.4865	2.4865	3.0630	3.0630
C4	1.5171	2.3689	2.1566		2.5402	1.0940	2.8143	1.0921	3.4798	1.0934	2.7755
C5	1.5171	2.3689	2.1566	2.5402		2.8143	1.0940	3.4798	1.0921	2.7755	1.0934
H6	2.1516	3.3187	2.5022	1.0940	2.8143		2.6468	1.7763	3.8118	1.7785	3.1535
H7	2.1516	3.3187	2.5022	2.8143	1.0940	2.6468		3.8118	1.7763	3.1535	1.7785
H8	2.1570	2.6116	2.4865	1.0921	3.4798	1.7763	3.8118		4.2975	1.7772	3.7642
H9	2.1570	2.6116	2.4865	3.4798	1.0921	3.8118	1.7763	4.2975		3.7642	1.7772
H10	2.1537	2.6507	3.0630	1.0934	2.7755	1.7785	3.1535	1.7772	3.7642		2.5621
H11	2.1537	2.6507	3.0630	2.7755	1.0934	3.1535	1.7785	3.7642	1.7772	2.5621

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C4	H8	110.459	C1	C4	H10	110.118
C1	C5	H7	109.923	C1	C5	H9	110.459
C1	C5	H11	110.118	F2	C1	H3	106.044
F2	C1	C4	108.149	F2	C1	C5	108.149
H3	C1	C4	110.243	H3	C1	C5	110.243
C4	C1	C5	113.683	H7	C5	H9	108.693
H7	C5	H11	108.796	H8	C4	H10	108.812
H9	C5	H11	108.812

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

using model chemistry: CCSD(T)/TZVP

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(T)/TZVP

States and conformations

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