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	hartrees
Energy at 0K	-1194.642323
Energy at 298.15K	-1194.642856
HF Energy	-1193.624026
Nuclear repulsion energy	348.867039

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_g	1743	1690
2	A_g	1208	1171
3	A_g	635	616
4	A_g	428	415
5	A_g	293	284
6	A_u	363	352
7	A_u	134	130
8	B_g	523	507
9	B_u	1232	1194
10	B_u	894	867
11	B_u	429	416
12	B_u	179	173

Atom	x (Å)	y (Å)
C1	-0.064	0.669
C2	0.064	-0.669
F3	-1.265	1.248
F4	1.265	-1.248
Cl5	1.265	1.749
Cl6	-1.265	-1.749

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3437	1.3337	2.3325	1.7123	2.6994
C2	1.3437		2.3325	1.3337	2.6994	1.7123
F3	1.3337	2.3325		3.5543	2.5794	2.9965
F4	2.3325	1.3337	3.5543		2.9965	2.5794
Cl5	1.7123	2.6994	2.5794	2.9965		4.3165
Cl6	2.6994	1.7123	2.9965	2.5794	4.3165

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	121.190	C1	C2	Cl6	123.641
C2	C1	F3	121.190	C2	C1	Cl5	123.641
F3	C1	Cl5	115.169	F4	C2	Cl6	115.169

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

using model chemistry: MP4/6-311G**

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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