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	hartrees
Energy at 0K	-178.685100
Energy at 298.15K	-178.690715
HF Energy	-178.128981
Nuclear repulsion energy	79.000392

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3127	3016
2	A'	3057	2949
3	A'	3047	2939
4	A'	1539	1484
5	A'	1510	1457
6	A'	1457	1406
7	A'	1413	1364
8	A'	1142	1102
9	A'	1096	1057
10	A'	903	871
11	A'	413	398
12	A"	3140	3029
13	A"	3103	2993
14	A"	1493	1440
15	A"	1319	1273
16	A"	1209	1166
17	A"	817	788
18	A"	273	263

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.562	0.000
C2	1.125	-0.459	0.000
F3	-1.227	-0.097	0.000
H4	0.038	1.197	0.893
H5	0.038	1.197	-0.893
H6	2.096	0.052	0.000
H7	1.061	-1.094	0.891
H8	1.061	-1.094	-0.891

	C1	C2	F3	H4	H5	H6	H7	H8
C1		1.5189	1.3926	1.0970	1.0970	2.1568	2.1592	2.1592
C2	1.5189		2.3795	2.1732	2.1732	1.0976	1.0957	1.0957
F3	1.3926	2.3795		2.0181	2.0181	3.3262	2.6505	2.6505
H4	1.0970	2.1732	2.0181		1.7870	2.5186	2.5097	3.0792
H5	1.0970	2.1732	2.0181	1.7870		2.5186	3.0792	2.5097
H6	2.1568	1.0976	3.3262	2.5186	2.5186		1.7828	1.7828
H7	2.1592	1.0957	2.6505	2.5097	3.0792	1.7828		1.7812
H8	2.1592	1.0957	2.6505	3.0792	2.5097	1.7828	1.7812

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	109.990	C1	C2	H7	110.294
C1	C2	H8	110.294	C2	C1	F3	109.548
C2	C1	H4	111.326	C2	C1	H5	111.326
F3	C1	H4	107.722	F3	C1	H5	107.722
H4	C1	H5	109.064	H6	C2	H7	108.741
H6	C2	H8	108.741	H7	C2	H8	108.738

All results from a given calculation for C₂H₅F (fluoroethane)

using model chemistry: CCSD(T)/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 C2H5F (fluoroethane)

using model chemistry: CCSD(T)/6-311G**

States and conformations

All results from a given calculation for C₂H₅F (fluoroethane)