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	hartrees
Energy at 0K	-175.875176
Energy at 298.15K	-175.880624
HF Energy	-175.751612
Nuclear repulsion energy	77.502296

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3564	3168	1.42
2	A'	3381	3005	0.96
3	A'	3340	2969	12.76
4	A'	1740	1547	0.07
5	A'	1713	1522	1.57
6	A'	1614	1435	4.85
7	A'	1570	1395	17.04
8	A'	1289	1146	7.95
9	A'	1183	1052	5.01
10	A'	1002	891	0.06
11	A'	419	373	1.64
12	A"	3565	3168	2.14
13	A"	3445	3063	12.66
14	A"	1721	1530	1.10
15	A"	1426	1267	0.32
16	A"	1275	1134	7.19
17	A"	879	782	0.35
18	A"	212	189	0.18

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.559	0.000
C2	1.148	-0.507	0.000
F3	-1.265	-0.050	0.000
H4	0.104	1.213	0.899
H5	0.104	1.213	-0.899
H6	2.128	-0.000	0.000
H7	1.081	-1.147	0.895
H8	1.081	-1.147	-0.895

	C1	C2	F3	H4	H5	H6	H7	H8
C1		1.5666	1.4041	1.1170	1.1170	2.2002	2.2089	2.2089
C2	1.5666		2.4566	2.2040	2.2040	1.1027	1.1027	1.1027
F3	1.4041	2.4566		2.0684	2.0684	3.3937	2.7404	2.7404
H4	1.1170	2.2040	2.0684		1.7989	2.5255	2.5540	3.1216
H5	1.1170	2.2040	2.0684	1.7989		2.5255	3.1216	2.5540
H6	2.2002	1.1027	3.3937	2.5255	2.5255		1.7924	1.7924
H7	2.2089	1.1027	2.7404	2.5540	3.1216	1.7924		1.7909
H8	2.2089	1.1027	2.7404	3.1216	2.5540	1.7924	1.7909

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	109.803	C1	C2	H7	110.479
C1	C2	H8	110.479	C2	C1	F3	111.455
C2	C1	H4	109.279	C2	C1	H5	109.279
F3	C1	H4	109.731	F3	C1	H5	109.731
H4	C1	H5	107.271	H6	C2	H7	108.725
H6	C2	H8	108.725	H7	C2	H8	108.583

All results from a given calculation for C₂H₅F (fluoroethane)

using model chemistry: MP2=FULL/STO-3G

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: MP2=FULL/STO-3G

States and conformations

All results from a given calculation for C₂H₅F (fluoroethane)