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	hartrees
Energy at 0K	-178.566197
Energy at 298.15K
HF Energy	-178.093477
Nuclear repulsion energy	78.898560

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.564	0.000
C2	1.135	-0.428	0.000
F3	-1.231	-0.132	0.000
H4	0.002	1.193	0.890
H5	0.002	1.193	-0.890
H6	2.088	0.104	0.000
H7	1.088	-1.058	0.885
H8	1.088	-1.058	-0.885

	C1	C2	F3	H4	H5	H6	H7	H8
C1		1.5078	1.4147	1.0892	1.0892	2.1381	2.1451	2.1451
C2	1.5078		2.3851	2.1685	2.1685	1.0906	1.0881	1.0881
F3	1.4147	2.3851		2.0168	2.0168	3.3275	2.6499	2.6499
H4	1.0892	2.1685	2.0168		1.7793	2.5159	2.4996	3.0658
H5	1.0892	2.1685	2.0168	1.7793		2.5159	3.0658	2.4996
H6	2.1381	1.0906	3.3275	2.5159	2.5159		1.7701	1.7701
H7	2.1451	1.0881	2.6499	2.4996	3.0658	1.7701		1.7709
H8	2.1451	1.0881	2.6499	3.0658	2.4996	1.7701	1.7709

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	109.701	C1	C2	H7	110.409
C1	C2	H8	110.409	C2	C1	F3	109.354
C2	C1	H4	112.236	C2	C1	H5	112.236
F3	C1	H4	106.586	F3	C1	H5	106.586
H4	C1	H5	109.531	H6	C2	H7	108.673
H6	C2	H8	108.673	H7	C2	H8	108.932

All results from a given calculation for C₂H₅F (fluoroethane)

using model chemistry: MP2/6-31+G**

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: MP2/6-31+G**

States and conformations

All results from a given calculation for C₂H₅F (fluoroethane)