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	hartrees
Energy at 0K	-637.092300
Energy at 298.15K	-637.094566
HF Energy	-637.092300
Nuclear repulsion energy	145.407065

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3287	3126	8.86
2	A'	3246	3087	3.92
3	A'	1767	1681	61.69
4	A'	1384	1316	26.92
5	A'	1285	1222	36.27
6	A'	1116	1062	80.42
7	A'	833	792	19.28
8	A'	673	640	21.77
9	A'	197	188	1.19
10	A"	899	855	0.06
11	A"	766	728	43.66
12	A"	463	441	8.57

Atom	x (Å)	y (Å)
C1	0.000	0.867
C2	1.247	0.416
Cl3	-1.377	-0.165
F4	1.558	-0.876
H5	-0.209	1.929
H6	2.110	1.074

	C1	C2	Cl3	F4	H5	H6
C1		1.3263	1.7206	2.3377	1.0824	2.1204
C2	1.3263		2.6877	1.3287	2.1002	1.0856
Cl3	1.7206	2.6877		3.0198	2.3973	3.7009
F4	2.3377	1.3287	3.0198		3.3152	2.0273
H5	1.0824	2.1002	2.3973	3.3152		2.4718
H6	2.1204	1.0856	3.7009	2.0273	2.4718

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.401	C1	C2	H6	122.764
C2	C1	Cl3	123.271	C2	C1	H5	121.031
Cl3	C1	H5	115.698	F4	C2	H6	113.834

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

using model chemistry: HSEh1PBE/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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Number	Element	Mulliken
1	C	-0.372
2	C	0.187
3	Cl	0.019
4	F	-0.245
5	H	0.226
6	H	0.184

	x	y	z	Total
	1.112	1.917	0.000	2.216
CHELPG
AIM
ESP

	x	y	z
x	6.771	0.372	0.000
y	0.372	4.284	0.000
z	0.000	0.000	2.202

<r²>	103.292
(<r²>)^1/2	10.163