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	hartrees
Energy at 0K	-736.721433
Energy at 298.15K	-736.725779
HF Energy	-735.879496
Nuclear repulsion energy	244.096732

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3177	3110
2	A'	3079	3013
3	A'	1471	1440
4	A'	1418	1388
5	A'	1262	1236
6	A'	1145	1121
7	A'	920	900
8	A'	681	666
9	A'	545	533
10	A'	434	425
11	A'	304	298
12	A"	3194	3126
13	A"	1472	1441
14	A"	1242	1215
15	A"	986	965
16	A"	428	419
17	A"	334	327
18	A"	255	249

Atom	x (Å)	y (Å)	z (Å)
C1	-0.351	-0.002	0.000
C2	-0.817	1.437	0.000
Cl3	1.443	-0.125	0.000
F4	-0.817	-0.657	1.090
F5	-0.817	-0.657	-1.090
H6	-1.922	1.439	0.000
H7	-0.445	1.949	0.902
H8	-0.445	1.949	-0.902

	C1	C2	Cl3	F4	F5	H6	H7	H8
C1		1.5132	1.7981	1.3542	1.3542	2.1319	2.1512	2.1512
C2	1.5132		2.7481	2.3606	2.3606	1.1044	1.1018	1.1018
Cl3	1.7981	2.7481		2.5653	2.5653	3.7108	2.9458	2.9458
F4	1.3542	2.3606	2.5653		2.1791	2.6075	2.6389	3.3006
F5	1.3542	2.3606	2.5653	2.1791		2.6075	3.3006	2.6389
H6	2.1319	1.1044	3.7108	2.6075	2.6075		1.8044	1.8044
H7	2.1512	1.1018	2.9458	2.6389	3.3006	1.8044		1.8037
H8	2.1512	1.1018	2.9458	3.3006	2.6389	1.8044	1.8037

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	108.053	C1	C2	H7	109.702
C1	C2	H8	109.702	C2	C1	Cl3	111.895
C2	C1	F4	110.707	C2	C1	F5	110.707
Cl3	C1	F4	108.109	Cl3	C1	F5	108.109
F4	C1	F5	107.139	H6	C2	H7	109.746
H6	C2	H8	109.746	H7	C2	H8	109.867

All results from a given calculation for CH₃CF₂Cl (1-Chloro-1,1-Difluoroethane)

using model chemistry: CCSD(T)/cc-pVDZ

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 CH3CF2Cl (1-Chloro-1,1-Difluoroethane)

using model chemistry: CCSD(T)/cc-pVDZ

States and conformations

All results from a given calculation for CH₃CF₂Cl (1-Chloro-1,1-Difluoroethane)