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	hartrees
Energy at 0K	-1194.986901
Energy at 298.15K	-1194.987417
HF Energy	-1193.694062
Nuclear repulsion energy	349.868216

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_g	1755	1697
2	A_g	1205	1165
3	A_g	637	615
4	A_g	427	413
5	A_g	287	277
6	A_u	360	348
7	A_u	133	129
8	B_g	526	508
9	B_u	1233	1192
10	B_u	890	861
11	B_u	425	411
12	B_u	173	167

Atom	x (Å)	y (Å)
C1	-0.061	0.665
C2	0.061	-0.665
F3	-1.260	1.242
F4	1.260	-1.242
Cl5	1.260	1.748
Cl6	-1.260	-1.748

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3363	1.3302	2.3202	1.7081	2.6948
C2	1.3363		2.3202	1.3302	2.6948	1.7081
F3	1.3302	2.3202		3.5383	2.5700	2.9902
F4	2.3202	1.3302	3.5383		2.9902	2.5700
Cl5	1.7081	2.6948	2.5700	2.9902		4.3096
Cl6	2.6948	1.7081	2.9902	2.5700	4.3096

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.948	C1	C2	Cl6	124.085
C2	C1	F3	120.948	C2	C1	Cl5	124.085
F3	C1	Cl5	114.967	F4	C2	Cl6	114.967

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

using model chemistry: QCISD(T)/aug-cc-pVTZ

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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