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	hartrees
Energy at 0K	-736.631249
Energy at 298.15K	-736.635605
HF Energy	-735.841275
Nuclear repulsion energy	244.356369

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3186	3042
2	A'	3093	2954
3	A'	1526	1457
4	A'	1465	1399
5	A'	1274	1216
6	A'	1181	1128
7	A'	933	891
8	A'	685	654
9	A'	535	511
10	A'	436	416
11	A'	306	292
12	A"	3199	3055
13	A"	1525	1456
14	A"	1260	1203
15	A"	1007	962
16	A"	430	410
17	A"	337	322
18	A"	272	259

Atom	x (Å)	y (Å)	z (Å)
C1	-0.342	0.006	0.000
C2	-0.816	1.435	0.000
Cl3	1.438	-0.130	0.000
F4	-0.816	-0.653	1.095
F5	-0.816	-0.653	-1.095
H6	-1.912	1.424	0.000
H7	-0.452	1.948	0.895
H8	-0.452	1.948	-0.895

	C1	C2	Cl3	F4	F5	H6	H7	H8
C1		1.5056	1.7853	1.3627	1.3627	2.1154	2.1413	2.1413
C2	1.5056		2.7438	2.3575	2.3575	1.0958	1.0938	1.0938
Cl3	1.7853	2.7438		2.5599	2.5599	3.6926	2.9482	2.9482
F4	1.3627	2.3575	2.5599		2.1891	2.5909	2.6340	3.2948
F5	1.3627	2.3575	2.5599	2.1891		2.5909	3.2948	2.6340
H6	2.1154	1.0958	3.6926	2.5909	2.5909		1.7902	1.7902
H7	2.1413	1.0938	2.9482	2.6340	3.2948	1.7902		1.7899
H8	2.1413	1.0938	2.9482	3.2948	2.6340	1.7902	1.7899

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	107.779	C1	C2	H7	109.917
C1	C2	H8	109.917	C2	C1	Cl3	112.702
C2	C1	F4	110.454	C2	C1	F5	110.454
Cl3	C1	F4	108.070	Cl3	C1	F5	108.070
F4	C1	F5	106.876	H6	C2	H7	109.694
H6	C2	H8	109.694	H7	C2	H8	109.811

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

using model chemistry: MP4/6-31G*

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: MP4/6-31G*

States and conformations

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