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	hartrees
Energy at 0K	-636.421599
Energy at 298.15K	-636.423879
HF Energy	-635.810602
Nuclear repulsion energy	144.321560

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3282	3140	7.87
2	A'	3254	3113	3.31
3	A'	1770	1693	55.15
4	A'	1381	1321	27.92
5	A'	1275	1220	33.66
6	A'	1100	1052	78.44
7	A'	830	794	15.41
8	A'	668	640	20.37
9	A'	198	189	1.52
10	A"	903	864	0.02
11	A"	771	737	34.26
12	A"	456	437	7.87

Atom	x (Å)	y (Å)
C1	0.000	0.874
C2	1.258	0.417
Cl3	-1.388	-0.167
F4	1.569	-0.882
H5	-0.200	1.947
H6	2.124	1.085

	C1	C2	Cl3	F4	H5	H6
C1		1.3378	1.7344	2.3546	1.0919	2.1347
C2	1.3378		2.7088	1.3362	2.1131	1.0941
Cl3	1.7344	2.7088		3.0415	2.4246	3.7283
F4	2.3546	1.3362	3.0415		3.3368	2.0442
H5	1.0919	2.1131	2.4246	3.3368		2.4791
H6	2.1347	1.0941	3.7283	2.0442	2.4791

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.416	C1	C2	H6	122.438
C2	C1	Cl3	123.181	C2	C1	H5	120.517
Cl3	C1	H5	116.302	F4	C2	H6	114.147

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

using model chemistry: CCD/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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