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	hartrees
Energy at 0K	-1195.929082
Energy at 298.15K	-1195.922237
HF Energy	-1196.250368
Nuclear repulsion energy	350.294431

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	1778	1715	0.00
2	A_g	1203	1161	0.00
3	A_g	645	622	0.00
4	A_g	425	410	0.00
5	A_g	290	280	0.00
6	A_u	373	360	1.08
7	A_u	135	130	0.03
8	B_g	559	540	0.00
9	B_u	1262	1218	270.05
10	B_u	866	835	184.96
11	B_u	425	410	1.66
12	B_u	176	170	2.21

Atom	x (Å)	y (Å)
C1	-0.072	0.662
C2	0.072	-0.662
F3	-1.259	1.236
F4	1.259	-1.236
Cl5	1.259	1.748
Cl6	-1.259	-1.748

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3317	1.3181	2.3179	1.7180	2.6862
C2	1.3317		2.3179	1.3181	2.6862	1.7180
F3	1.3181	2.3179		3.5280	2.5693	2.9837
F4	2.3179	1.3181	3.5280		2.9837	2.5693
Cl5	1.7180	2.6862	2.5693	2.9837		4.3082
Cl6	2.6862	1.7180	2.9837	2.5693	4.3082

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	121.936	C1	C2	Cl6	123.356
C2	C1	F3	121.936	C2	C1	Cl5	123.356
F3	C1	Cl5	114.708	F4	C2	Cl6	114.708

All results from a given calculation for CFClCClF (trans-1,2-dichloro-1,2-difluoroethylene)

using model chemistry: G4

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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Number	Element	Mulliken
1	C	0.137
2	C	0.137
3	F	-0.042
4	F	-0.042
5	Cl	-0.095
6	Cl	-0.095

<r²>	247.155
(<r²>)^1/2	15.721