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	hartrees
Energy at 0K	-50.571032
Energy at 298.15K	-50.573225
HF Energy	-50.571032
Nuclear repulsion energy	55.837646

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3427	3127	1.47
2	A'	3415	3116	15.36
3	A'	1826	1666	22.05
4	A'	1414	1290	1.18
5	A'	1337	1220	6.75
6	A'	1152	1051	178.71
7	A'	892	814	71.52
8	A'	455	415	2.35
9	A'	283	258	12.38
10	A"	1036	946	101.07
11	A"	933	852	20.86
12	A"	287	262	5.92

Atom	x (Å)	y (Å)
C1	0.000	0.480
C2	1.050	-0.323
Cl3	-1.662	-0.182
F4	2.315	0.222
H5	0.054	1.548
H6	1.059	-1.394

	C1	C2	Cl3	F4	H5	H6
C1		1.3223	1.7889	2.3297	1.0696	2.1520
C2	1.3223		2.7160	1.3776	2.1200	1.0704
Cl3	1.7889	2.7160		3.9979	2.4369	2.9783
F4	2.3297	1.3776	3.9979		2.6212	2.0471
H5	1.0696	2.1200	2.4369	2.6212		3.1086
H6	2.1520	1.0704	2.9783	2.0471	3.1086

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	119.269	C1	C2	H6	127.848
C2	C1	Cl3	120.883	C2	C1	H5	124.495
Cl3	C1	H5	114.622	F4	C2	H6	112.883

All results from a given calculation for CHFCHCl ((E)-1-chloro-2-fluoroethene)

using model chemistry: HF/CEP-121G

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	-0.316
2	C	0.221
3	Cl	-0.027
4	F	-0.308
5	H	0.237
6	H	0.194

	x	y	z	Total
	-0.096	-0.284	0.000	0.300
CHELPG
AIM
ESP

	x	y	z
x	7.175	-0.235	0.000
y	-0.235	3.961	0.000
z	0.000	0.000	2.155

<r²>	87.957
(<r²>)^1/2	9.379