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	hartrees
Energy at 0K	-636.046026
Energy at 298.15K	-636.048212
HF Energy	-635.693213
Nuclear repulsion energy	140.518843

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3310	3145	5.79
2	A'	3274	3111	2.84
3	A'	1703	1618	26.15
4	A'	1384	1315	18.28
5	A'	1267	1204	7.21
6	A'	1027	976	67.82
7	A'	759	721	11.02
8	A'	615	585	22.95
9	A'	194	184	2.00
10	A"	911	866	1.28
11	A"	776	737	51.47
12	A"	438	416	9.80

Atom	x (Å)	y (Å)
C1	0.000	0.911
C2	1.271	0.492
Cl3	-1.416	-0.218
F4	1.619	-0.868
H5	-0.264	1.960
H6	2.136	1.147

	C1	C2	Cl3	F4	H5	H6
C1		1.3385	1.8110	2.4053	1.0823	2.1489
C2	1.3385		2.7799	1.4040	2.1243	1.0843
Cl3	1.8110	2.7799		3.1042	2.4644	3.8052
F4	2.4053	1.4040	3.1042		3.3978	2.0800
H5	1.0823	2.1243	2.4644	3.3978		2.5339
H6	2.1489	1.0843	3.8052	2.0800	2.5339

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.560	C1	C2	H6	124.647
C2	C1	Cl3	123.226	C2	C1	H5	122.330
Cl3	C1	H5	114.445	F4	C2	H6	112.793

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

using model chemistry: MP2=FULL/6-31G

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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