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	hartrees
Energy at 0K	-1195.143923
Energy at 298.15K	-1195.147114
HF Energy	-1194.629073
Nuclear repulsion energy	362.498218

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3213	3101	11.93
2	A'	3201	3090	1.78
3	A'	1411	1362	18.04
4	A'	1260	1216	3.61
5	A'	1126	1087	55.15
6	A'	982	948	71.52
7	A'	733	708	29.59
8	A'	498	481	8.36
9	A'	366	353	30.43
10	A'	325	314	8.94
11	A'	235	227	0.09
12	A"	1347	1300	4.68
13	A"	1239	1196	8.89
14	A"	995	960	128.57
15	A"	754	728	78.78
16	A"	367	354	0.72
17	A"	173	167	2.43
18	A"	72	70	1.58

Atom	x (Å)	y (Å)	z (Å)
C1	0.431	-0.210	0.000
C2	-0.374	1.104	0.000
H3	1.516	-0.060	0.000
H4	-1.460	0.954	0.000
Cl5	-0.008	-1.184	1.540
Cl6	-0.008	-1.184	-1.540
F7	-0.008	1.889	1.148
F8	-0.008	1.889	-1.148

	C1	C2	H3	H4	Cl5	Cl6	F7	F8
C1		1.5412	1.0955	2.2205	1.8744	1.8744	2.4320	2.4320
C2	1.5412		2.2205	1.0955	2.7824	2.7824	1.4383	1.4383
H3	1.0955	2.2205		3.1441	2.4408	2.4408	2.7274	2.7274
H4	2.2205	1.0955	3.1441		3.0088	3.0088	2.0737	2.0737
Cl5	1.8744	2.7824	2.4408	3.0088		3.0801	3.0975	4.0828
Cl6	1.8744	2.7824	2.4408	3.0088	3.0801		4.0828	3.0975
F7	2.4320	1.4383	2.7274	2.0737	3.0975	4.0828		2.2968
F8	2.4320	1.4383	2.7274	2.0737	4.0828	3.0975	2.2968

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	113.658	C1	C2	F7	109.370
C1	C2	F8	109.370	C2	C1	H3	113.658
C2	C1	Cl5	108.707	C2	C1	Cl6	108.707
H3	C1	Cl5	107.635	H3	C1	Cl6	107.635
H4	C2	F7	109.101	H4	C2	F8	109.101
Cl5	C1	Cl6	110.493	F7	C2	F8	105.955

All results from a given calculation for CHCl₂CHF₂ (1,1-dichloro-2,2-difluoroethane)

using model chemistry: MP2/SDD

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 CHCl2CHF2 (1,1-dichloro-2,2-difluoroethane)

using model chemistry: MP2/SDD

States and conformations

All results from a given calculation for CHCl₂CHF₂ (1,1-dichloro-2,2-difluoroethane)