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	hartrees
Energy at 0K	-1194.678578
Energy at 298.15K	-1194.679037
HF Energy	-1193.657269
Nuclear repulsion energy	348.023634

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_g	1737	1672
2	A_g	1192	1148
3	A_g	632	609
4	A_g	424	409
5	A_g	290	279
6	A_u	345	332
7	A_u	129	124
8	B_g	489	471
9	B_u	1219	1174
10	B_u	881	848
11	B_u	425	409
12	B_u	176	170

Atom	x (Å)	y (Å)
C1	-0.062	0.666
C2	0.062	-0.666
F3	-1.267	1.243
F4	1.267	-1.243
Cl5	1.267	1.760
Cl6	-1.267	-1.760

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3384	1.3357	2.3268	1.7213	2.7087
C2	1.3384		2.3268	1.3357	2.7087	1.7213
F3	1.3357	2.3268		3.5503	2.5860	3.0031
F4	2.3268	1.3357	3.5503		3.0031	2.5860
Cl5	1.7213	2.7087	2.5860	3.0031		4.3368
Cl6	2.7087	1.7213	3.0031	2.5860	4.3368

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.944	C1	C2	Cl6	124.092
C2	C1	F3	120.944	C2	C1	Cl5	124.092
F3	C1	Cl5	114.964	F4	C2	Cl6	114.964

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

using model chemistry: MP4/TZVP

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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