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	hartrees
Energy at 0K	-632.627416
Energy at 298.15K	-632.629830
HF Energy	-632.627416
Nuclear repulsion energy	143.948180

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3485	3156	9.75
2	A'	3430	3107	2.70
3	A'	1911	1730	45.82
4	A'	1501	1359	26.45
5	A'	1370	1240	25.71
6	A'	1155	1046	78.73
7	A'	822	744	10.19
8	A'	654	592	37.56
9	A'	212	192	2.16
10	A"	1134	1027	2.84
11	A"	887	804	61.42
12	A"	498	451	14.32

Atom	x (Å)	y (Å)
C1	0.000	0.914
C2	1.231	0.497
Cl3	-1.374	-0.252
F4	1.576	-0.809
H5	-0.279	1.940
H6	2.067	1.161

	C1	C2	Cl3	F4	H5	H6
C1		1.3000	1.8023	2.3354	1.0635	2.0820
C2	1.3000		2.7113	1.3515	2.0887	1.0670
Cl3	1.8023	2.7113		3.0023	2.4509	3.7202
F4	2.3354	1.3515	3.0023		3.3168	2.0302
H5	1.0635	2.0887	2.4509	3.3168		2.4724
H6	2.0820	1.0670	3.7202	2.0302	2.4724

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.462	C1	C2	H6	122.886
C2	C1	Cl3	120.990	C2	C1	H5	123.889
Cl3	C1	H5	115.121	F4	C2	H6	113.652

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

using model chemistry: HF/3-21G

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	-0.548
2	C	0.274
3	Cl	0.075
4	F	-0.367
5	H	0.302
6	H	0.265

	x	y	z	Total
	1.457	2.939	0.000	3.280
CHELPG
AIM
ESP

	x	y	z
x	6.290	0.645	0.000
y	0.645	3.795	0.000
z	0.000	0.000	1.292

<r²>	104.739
(<r²>)^1/2	10.234