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	hartrees
Energy at 0K	-736.627457
Energy at 298.15K	-736.631828
HF Energy	-735.841657
Nuclear repulsion energy	244.662442

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3178	3057
2	A'	3088	2971
3	A'	1524	1467
4	A'	1466	1411
5	A'	1282	1233
6	A'	1184	1139
7	A'	940	904
8	A'	690	664
9	A'	539	519
10	A'	439	422
11	A'	307	296
12	A"	3192	3071
13	A"	1523	1465
14	A"	1272	1224
15	A"	1014	975
16	A"	431	415
17	A"	339	326
18	A"	270	260

Atom	x (Å)	y (Å)	z (Å)
C1	-0.342	0.005	0.000
C2	-0.815	1.435	0.000
Cl3	1.437	-0.131	0.000
F4	-0.815	-0.652	1.092
F5	-0.815	-0.652	-1.092
H6	-1.911	1.424	0.000
H7	-0.451	1.948	0.895
H8	-0.451	1.948	-0.895

	C1	C2	Cl3	F4	F5	H6	H7	H8
C1		1.5061	1.7834	1.3595	1.3595	2.1156	2.1415	2.1415
C2	1.5061		2.7425	2.3553	2.3553	1.0960	1.0940	1.0940
Cl3	1.7834	2.7425		2.5560	2.5560	3.6910	2.9470	2.9470
F4	1.3595	2.3553	2.5560		2.1840	2.5891	2.6323	3.2923
F5	1.3595	2.3553	2.5560	2.1840		2.5891	3.2923	2.6323
H6	2.1156	1.0960	3.6910	2.5891	2.5891		1.7908	1.7908
H7	2.1415	1.0940	2.9470	2.6323	3.2923	1.7908		1.7905
H8	2.1415	1.0940	2.9470	3.2923	2.6323	1.7908	1.7905

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	107.747	C1	C2	H7	109.895
C1	C2	H8	109.895	C2	C1	Cl3	112.697
C2	C1	F4	110.454	C2	C1	F5	110.454
Cl3	C1	F4	108.073	Cl3	C1	F5	108.073
F4	C1	F5	106.875	H6	C2	H7	109.718
H6	C2	H8	109.718	H7	C2	H8	109.838

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

using model chemistry: CCSD(T)/6-31G*

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)/6-31G*

States and conformations

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