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	hartrees
Energy at 0K	-1194.959138
Energy at 298.15K	-1194.959657
HF Energy	-1193.688913
Nuclear repulsion energy	349.581002

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A_g	1741	1688
2	A_g	1204	1167
3	A_g	634	615
4	A_g	426	413
5	A_g	287	279
6	A_u	364	353
7	A_u	133	129
8	B_g	525	509
9	B_u	1236	1198
10	B_u	887	860
11	B_u	424	411
12	B_u	174	169

Atom	x (Å)	y (Å)
C1	-0.064	0.667
C2	0.064	-0.667
F3	-1.262	1.244
F4	1.262	-1.244
Cl5	1.262	1.747
Cl6	-1.262	-1.747

	C1	C2	F3	F4	Cl5	Cl6
C1		1.3394	1.3304	2.3255	1.7099	2.6946
C2	1.3394		2.3255	1.3304	2.6946	1.7099
F3	1.3304	2.3255		3.5443	2.5739	2.9906
F4	2.3255	1.3304	3.5443		2.9906	2.5739
Cl5	1.7099	2.6946	2.5739	2.9906		4.3099
Cl6	2.6946	1.7099	2.9906	2.5739	4.3099

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	121.161	C1	C2	Cl6	123.722
C2	C1	F3	121.161	C2	C1	Cl5	123.722
F3	C1	Cl5	115.117	F4	C2	Cl6	115.117

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

using model chemistry: MP4/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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