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	hartrees
Energy at 0K	-637.090765
Energy at 298.15K	-637.093028
HF Energy	-636.904411
Nuclear repulsion energy	144.923034

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3298	3298	8.78
2	A'	3264	3264	4.04
3	A'	1745	1745	55.13
4	A'	1389	1389	25.09
5	A'	1283	1283	29.10
6	A'	1102	1102	83.11
7	A'	824	824	17.74
8	A'	665	665	22.27
9	A'	199	199	1.33
10	A"	890	890	0.03
11	A"	767	767	37.98
12	A"	457	457	7.94

Atom	x (Å)	y (Å)
C1	0.000	0.873
C2	1.251	0.424
Cl3	-1.379	-0.170
F4	1.560	-0.879
H5	-0.210	1.931
H6	2.112	1.078

	C1	C2	Cl3	F4	H5	H6
C1		1.3290	1.7289	2.3456	1.0789	2.1223
C2	1.3290		2.6962	1.3389	2.0990	1.0817
Cl3	1.7289	2.6962		3.0235	2.4041	3.7078
F4	2.3456	1.3389	3.0235		3.3209	2.0333
H5	1.0789	2.0990	2.4041	3.3209		2.4743
H6	2.1223	1.0817	3.7078	2.0333	2.4743

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.090	C1	C2	H6	123.053
C2	C1	Cl3	123.170	C2	C1	H5	120.977
Cl3	C1	H5	115.853	F4	C2	H6	113.857

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

using model chemistry: B2PLYP/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	-0.278
2	C	0.252
3	Cl	0.003
4	F	-0.264
5	H	0.161
6	H	0.126

	x	y	z	Total
	1.070	1.979	0.000	2.250
CHELPG
AIM
ESP

	x	y	z
x	6.709	0.375	0.000
y	0.375	4.303	0.000
z	0.000	0.000	2.193

<r²>	103.843
(<r²>)^1/2	10.190