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	hartrees
Energy at 0K	-1195.687069
Energy at 298.15K	-1195.690592
HF Energy	-1194.725233
Nuclear repulsion energy	377.813235

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3156	3035
2	A'	3145	3024
3	A'	1453	1397
4	A'	1281	1232
5	A'	1164	1119
6	A'	1100	1058
7	A'	814	782
8	A'	565	543
9	A'	401	385
10	A'	351	338
11	A'	258	248
12	A"	1412	1358
13	A"	1299	1249
14	A"	1164	1120
15	A"	851	818
16	A"	403	387
17	A"	185	178
18	A"	83	80

Atom	x (Å)	y (Å)	z (Å)
C1	0.402	-0.227	0.000
C2	-0.363	1.093	0.000
H3	1.483	-0.052	0.000
H4	-1.444	0.919	0.000
Cl5	-0.005	-1.138	1.470
Cl6	-0.005	-1.138	-1.470
F7	-0.005	1.812	1.102
F8	-0.005	1.812	-1.102

	C1	C2	H3	H4	Cl5	Cl6	F7	F8
C1		1.5258	1.0945	2.1725	1.7770	1.7770	2.3533	2.3533
C2	1.5258		2.1725	1.0945	2.6958	2.6958	1.3639	1.3639
H3	1.0945	2.1725		3.0834	2.3568	2.3568	2.6278	2.6278
H4	2.1725	1.0945	3.0834		2.9086	2.9086	2.0206	2.0206
Cl5	1.7770	2.6958	2.3568	2.9086		2.9402	2.9729	3.9142
Cl6	1.7770	2.6958	2.3568	2.9086	2.9402		3.9142	2.9729
F7	2.3533	1.3639	2.6278	2.0206	2.9729	3.9142		2.2049
F8	2.3533	1.3639	2.6278	2.0206	3.9142	2.9729	2.2049

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H4	110.939	C1	C2	F7	108.923
C1	C2	F8	108.923	C2	C1	H3	110.939
C2	C1	Cl5	109.182	C2	C1	Cl6	109.182
H3	C1	Cl5	107.950	H3	C1	Cl6	107.950
H4	C2	F7	110.065	H4	C2	F8	110.065
Cl5	C1	Cl6	111.638	F7	C2	F8	107.858

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

using model chemistry: MP4=FULL/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 CHCl2CHF2 (1,1-dichloro-2,2-difluoroethane)

using model chemistry: MP4=FULL/6-31G*

States and conformations

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