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	hartrees
Energy at 0K	-636.687387
Energy at 298.15K	-636.689660
HF Energy	-635.888069
Nuclear repulsion energy	145.363139

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3269	3146	5.12
2	A'	3240	3118	6.89
3	A'	1738	1673	58.70
4	A'	1372	1321	23.98
5	A'	1267	1220	35.85
6	A'	1089	1048	80.89
7	A'	823	792	16.01
8	A'	666	641	20.68
9	A'	198	190	1.53
10	A"	894	860	0.53
11	A"	763	735	41.44
12	A"	455	438	6.73

Atom	x (Å)	y (Å)
C1	0.000	0.868
C2	1.249	0.424
Cl3	-1.376	-0.170
F4	1.554	-0.874
H5	-0.203	1.926
H6	2.110	1.075

	C1	C2	Cl3	F4	H5	H6
C1		1.3255	1.7236	2.3352	1.0770	2.1199
C2	1.3255		2.6909	1.3337	2.0890	1.0795
Cl3	1.7236	2.6909		3.0136	2.4019	3.7012
F4	2.3352	1.3337	3.0136		3.3061	2.0269
H5	1.0770	2.0890	2.4019	3.3061		2.4644
H6	2.1199	1.0795	3.7012	2.0269	2.4644

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.837	C1	C2	H6	123.319
C2	C1	Cl3	123.367	C2	C1	H5	120.450
Cl3	C1	H5	116.184	F4	C2	H6	113.844

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

using model chemistry: QCISD/aug-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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