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	hartrees
Energy at 0K	-1393.669558
Energy at 298.15K	-1393.671783
HF Energy	-1392.429011
Nuclear repulsion energy	612.696202

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1362	1282	0.00
2	A_g	1137	1070	0.00
3	A_g	714	672	0.00
4	A_g	456	429	0.00
5	A_g	362	341	0.00
6	A_g	264	248	0.00
7	A_u	1274	1199	354.56
8	A_u	385	362	0.93
9	A_u	225	211	1.85
10	A_u	73	68	0.26
11	B_g	1266	1192	0.00
12	B_g	557	525	0.00
13	B_g	333	313	0.00
14	B_u	1196	1126	361.42
15	B_u	887	835	342.75
16	B_u	605	569	15.43
17	B_u	445	419	3.09
18	B_u	175	165	1.54

Atom	x (Å)	y (Å)	z (Å)
C1	-0.243	0.732	0.000
C2	0.243	-0.732	0.000
Cl3	-1.999	0.813	0.000
Cl4	1.999	-0.813	0.000
F5	0.243	1.348	1.093
F6	0.243	1.348	-1.093
F7	-0.243	-1.348	1.093
F8	-0.243	-1.348	-1.093

	C1	C2	Cl3	Cl4	F5	F6	F7	F8
C1		1.5417	1.7575	2.7223	1.3455	1.3455	2.3494	2.3494
C2	1.5417		2.7223	1.7575	2.3494	2.3494	1.3455	1.3455
Cl3	1.7575	2.7223		4.3154	2.5503	2.5503	2.9915	2.9915
Cl4	2.7223	1.7575	4.3154		2.9915	2.9915	2.5503	2.5503
F5	1.3455	2.3494	2.5503	2.9915		2.1855	2.7399	3.5048
F6	1.3455	2.3494	2.5503	2.9915	2.1855		3.5048	2.7399
F7	2.3494	1.3455	2.9915	2.5503	2.7399	3.5048		2.1855
F8	2.3494	1.3455	2.9915	2.5503	3.5048	2.7399	2.1855

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl4	111.036	C1	C2	F7	108.735
C1	C2	F8	108.735	C2	C1	Cl3	111.036
C2	C1	F5	108.735	C2	C1	F6	108.735
Cl3	C1	F5	109.837	Cl3	C1	F6	109.837
Cl4	C2	F7	109.837	Cl4	C2	F8	109.837
F5	C1	F6	108.612	F7	C2	F8	108.612

All results from a given calculation for CF₂ClCF₂Cl (1,2-Dichloro-1,1,2,2-tetrafluoroethane)

using model chemistry: QCISD/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 CF2ClCF2Cl (1,2-Dichloro-1,1,2,2-tetrafluoroethane)

using model chemistry: QCISD/6-31G**

States and conformations

All results from a given calculation for CF₂ClCF₂Cl (1,2-Dichloro-1,1,2,2-tetrafluoroethane)