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	hartrees
Energy at 0K	-636.489336
Energy at 298.15K	-636.491636
HF Energy	-635.849449
Nuclear repulsion energy	145.107659

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3281	3133	8.90
2	A'	3251	3105	3.90
3	A'	1760	1681	55.11
4	A'	1390	1327	27.37
5	A'	1290	1232	28.96
6	A'	1111	1061	90.74
7	A'	838	801	16.46
8	A'	673	643	20.04
9	A'	203	194	1.69
10	A"	905	865	0.01
11	A"	775	740	42.41
12	A"	458	437	10.00

Atom	x (Å)	y (Å)
C1	0.000	0.867
C2	1.252	0.419
Cl3	-1.381	-0.166
F4	1.561	-0.877
H5	-0.205	1.928
H6	2.113	1.078

	C1	C2	Cl3	F4	H5	H6
C1		1.3296	1.7244	2.3404	1.0811	2.1230
C2	1.3296		2.6966	1.3318	2.0982	1.0840
Cl3	1.7244	2.6966		3.0264	2.4017	3.7080
F4	2.3404	1.3318	3.0264		3.3149	2.0305
H5	1.0811	2.0982	2.4017	3.3149		2.4691
H6	2.1230	1.0840	3.7080	2.0305	2.4691

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.136	C1	C2	H6	122.864
C2	C1	Cl3	123.492	C2	C1	H5	120.651
Cl3	C1	H5	115.857	F4	C2	H6	114.001

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

using model chemistry: CCD/6-311G**

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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