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	hartrees
Energy at 0K	-637.327215
Energy at 298.15K	-637.329382
HF Energy	-637.327215
Nuclear repulsion energy	143.991422

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3199	3137	11.49
2	A'	3156	3094	4.98
3	A'	1688	1655	58.65
4	A'	1345	1319	25.60
5	A'	1249	1225	28.22
6	A'	1070	1049	84.67
7	A'	789	773	17.82
8	A'	642	630	25.83
9	A'	195	191	1.05
10	A"	832	816	0.00
11	A"	728	714	41.01
12	A"	441	433	7.71

Atom	x (Å)	y (Å)
C1	0.000	0.871
C2	1.258	0.418
Cl3	-1.393	-0.164
F4	1.581	-0.885
H5	-0.210	1.937
H6	2.123	1.082

	C1	C2	Cl3	F4	H5	H6
C1		1.3372	1.7359	2.3627	1.0869	2.1336
C2	1.3372		2.7150	1.3426	2.1126	1.0904
Cl3	1.7359	2.7150		3.0602	2.4120	3.7310
F4	2.3627	1.3426	3.0602		3.3425	2.0409
H5	1.0869	2.1126	2.4120	3.3425		2.4847
H6	2.1336	1.0904	3.7310	2.0409	2.4847

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.678	C1	C2	H6	122.692
C2	C1	Cl3	123.605	C2	C1	H5	120.918
Cl3	C1	H5	115.477	F4	C2	H6	113.630

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

using model chemistry: B97D3/6-31G*

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	-0.324
2	C	0.186
3	Cl	0.009
4	F	-0.231
5	H	0.200
6	H	0.160

	x	y	z	Total
	1.063	1.831	0.000	2.117
CHELPG
AIM
ESP

	x	y	z
x	6.991	0.407	0.000
y	0.407	4.424	0.000
z	0.000	0.000	2.219

<r²>	105.106
(<r²>)^1/2	10.252