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	hartrees
Energy at 0K	-637.094038
Energy at 298.15K	-637.096204
HF Energy	-637.094038
Nuclear repulsion energy	144.104752

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3167	3134	10.50
2	A'	3127	3094	3.98
3	A'	1669	1652	60.64
4	A'	1316	1302	23.24
5	A'	1227	1214	31.49
6	A'	1053	1042	97.70
7	A'	790	782	19.08
8	A'	644	637	23.53
9	A'	190	188	1.11
10	A"	826	818	0.00
11	A"	717	709	53.97
12	A"	446	441	10.41

Atom	x (Å)	y (Å)
C1	0.000	0.869
C2	1.256	0.418
Cl3	-1.392	-0.164
F4	1.580	-0.884
H5	-0.213	1.937
H6	2.124	1.082

	C1	C2	Cl3	F4	H5	H6
C1		1.3348	1.7337	2.3604	1.0890	2.1350
C2	1.3348		2.7118	1.3423	2.1132	1.0928
Cl3	1.7337	2.7118		3.0584	2.4093	3.7309
F4	2.3604	1.3423	3.0584		3.3431	2.0405
H5	1.0890	2.1132	2.4093	3.3431		2.4889
H6	2.1350	1.0928	3.7309	2.0405	2.4889

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.699	C1	C2	H6	122.848
C2	C1	Cl3	123.681	C2	C1	H5	121.025
Cl3	C1	H5	115.294	F4	C2	H6	113.452

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

using model chemistry: PBEPBE/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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Number	Element	Mulliken
1	C	-0.393
2	C	0.083
3	Cl	-0.010
4	F	-0.160
5	H	0.265
6	H	0.216

	x	y	z	Total
	1.031	1.874	0.000	2.139
CHELPG
AIM
ESP

	x	y	z
x	7.267	0.557	0.000
y	0.557	4.570	0.000
z	0.000	0.000	2.396

<r²>	105.487
(<r²>)^1/2	10.271