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	hartrees
Energy at 0K	-178.756409
Energy at 298.15K
HF Energy	-178.149680
Nuclear repulsion energy	79.432911

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3179	3018	17.18
2	A'	3096	2940	35.99
3	A'	3088	2932	9.06
4	A'	1545	1467	0.68
5	A'	1518	1441	1.50
6	A'	1444	1371	25.55
7	A'	1407	1336	2.48
8	A'	1142	1085	33.12
9	A'	1104	1049	65.94
10	A'	906	860	12.56
11	A'	414	393	5.84
12	A"	3192	3030	26.27
13	A"	3151	2992	18.17
14	A"	1499	1423	5.02
15	A"	1323	1256	0.24
16	A"	1204	1143	4.89
17	A"	818	777	0.48
18	A"	262	249	0.59

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.557	0.000
C2	1.121	-0.450	0.000
F3	-1.223	-0.103	0.000
H4	0.032	1.190	0.886
H5	0.032	1.190	-0.886
H6	2.081	0.064	0.000
H7	1.066	-1.081	0.884
H8	1.066	-1.081	-0.884

	C1	C2	F3	H4	H5	H6	H7	H8
C1		1.5067	1.3892	1.0890	1.0890	2.1391	2.1445	2.1445
C2	1.5067		2.3693	2.1581	2.1581	1.0890	1.0872	1.0872
F3	1.3892	2.3693		2.0073	2.0073	3.3083	2.6411	2.6411
H4	1.0890	2.1581	2.0073		1.7712	2.5002	2.4946	3.0583
H5	1.0890	2.1581	2.0073	1.7712		2.5002	3.0583	2.4946
H6	2.1391	1.0890	3.3083	2.5002	2.5002		1.7668	1.7668
H7	2.1445	1.0872	2.6411	2.4946	3.0583	1.7668		1.7671
H8	2.1445	1.0872	2.6411	3.0583	2.4946	1.7668	1.7671

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	109.953	C1	C2	H7	110.491
C1	C2	H8	110.491	C2	C1	F3	109.740
C2	C1	H4	111.479	C2	C1	H5	111.479
F3	C1	H4	107.577	F3	C1	H5	107.577
H4	C1	H5	108.834	H6	C2	H7	108.563
H6	C2	H8	108.563	H7	C2	H8	108.726

All results from a given calculation for C₂H₅F (fluoroethane)

using model chemistry: MP2/cc-pVTZ

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/cc-pVTZ

States and conformations

All results from a given calculation for C₂H₅F (fluoroethane)