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	hartrees
Energy at 0K	-636.455740
Energy at 298.15K	-636.457971
HF Energy	-635.809865
Nuclear repulsion energy	143.981079

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3261	3141
2	A'	3233	3114
3	A'	1721	1658
4	A'	1360	1310
5	A'	1256	1210
6	A'	1079	1040
7	A'	815	785
8	A'	659	634
9	A'	194	187
10	A"	865	833
11	A"	750	722
12	A"	444	428

Atom	x (Å)	y (Å)
C1	0.000	0.878
C2	1.262	0.415
Cl3	-1.390	-0.163
F4	1.569	-0.890
H5	-0.196	1.953
H6	2.132	1.081

	C1	C2	Cl3	F4	H5	H6
C1		1.3446	1.7365	2.3635	1.0929	2.1414
C2	1.3446		2.7144	1.3403	2.1197	1.0952
Cl3	1.7365	2.7144		3.0463	2.4298	3.7348
F4	2.3635	1.3403	3.0463		3.3462	2.0497
H5	1.0929	2.1197	2.4298	3.3462		2.4859
H6	2.1414	1.0952	3.7348	2.0497	2.4859

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.358	C1	C2	H6	122.400
C2	C1	Cl3	123.014	C2	C1	H5	120.482
Cl3	C1	H5	116.504	F4	C2	H6	114.243

All results from a given calculation for CHFCHClz ((Z)-1-Chloro-2-fluoroethene)

using model chemistry: CCSD(T)=FULL/cc-pVDZ

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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