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	hartrees
Energy at 0K	-736.735610
Energy at 298.15K	-736.739961
HF Energy	-735.879669
Nuclear repulsion energy	244.268561

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3184	3067
2	A'	3085	2971
3	A'	1474	1419
4	A'	1420	1368
5	A'	1264	1218
6	A'	1146	1104
7	A'	921	887
8	A'	682	656
9	A'	546	526
10	A'	435	419
11	A'	305	294
12	A"	3200	3083
13	A"	1475	1420
14	A"	1243	1197
15	A"	987	951
16	A"	429	413
17	A"	334	322
18	A"	255	246

Atom	x (Å)	y (Å)	z (Å)
C1	-0.350	-0.002	0.000
C2	-0.817	1.436	0.000
Cl3	1.442	-0.125	0.000
F4	-0.817	-0.657	1.089
F5	-0.817	-0.657	-1.089
H6	-1.920	1.438	0.000
H7	-0.444	1.947	0.901
H8	-0.444	1.947	-0.901

	C1	C2	Cl3	F4	F5	H6	H7	H8
C1		1.5118	1.7964	1.3536	1.3536	2.1301	2.1494	2.1494
C2	1.5118		2.7455	2.3589	2.3589	1.1032	1.1008	1.1008
Cl3	1.7964	2.7455		2.5636	2.5636	3.7074	2.9432	2.9432
F4	1.3536	2.3589	2.5636		2.1781	2.6055	2.6370	3.2982
F5	1.3536	2.3589	2.5636	2.1781		2.6055	3.2982	2.6370
H6	2.1301	1.1032	3.7074	2.6055	2.6055		1.8025	1.8025
H7	2.1494	1.1008	2.9432	2.6370	3.2982	1.8025		1.8018
H8	2.1494	1.1008	2.9432	3.2982	2.6370	1.8025	1.8018

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	108.068	C1	C2	H7	109.712
C1	C2	H8	109.712	C2	C1	Cl3	111.892
C2	C1	F4	110.703	C2	C1	F5	110.703
Cl3	C1	F4	108.118	Cl3	C1	F5	108.118
F4	C1	F5	107.134	H6	C2	H7	109.737
H6	C2	H8	109.737	H7	C2	H8	109.847

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

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

States and conformations

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