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	hartrees
Energy at 0K	-637.339641
Energy at 298.15K	-637.341737
HF Energy	-637.339641
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3284	3115	8.58
2	A'	3261	3093	5.63
3	A'	1765	1674	28.50
4	A'	1351	1282	0.04
5	A'	1274	1209	3.79
6	A'	1197	1136	173.45
7	A'	899	853	56.23
8	A'	458	435	1.82
9	A'	277	262	6.07
10	A"	943	894	51.30
11	A"	816	774	20.26
12	A"	280	265	1.71

Atom	x (Å)	y (Å)
C1	0.000	0.477
C2	1.028	-0.360
Cl3	-1.633	-0.101
F4	2.281	0.100
H5	0.116	1.553
H6	0.958	-1.442

	C1	C2	Cl3	F4	H5	H6
C1		1.3249	1.7325	2.3119	1.0826	2.1449
C2	1.3249		2.6735	1.3349	2.1190	1.0848
Cl3	1.7325	2.6735		3.9195	2.4071	2.9184
F4	2.3119	1.3349	3.9195		2.6080	2.0314
H5	1.0826	2.1190	2.4071	2.6080		3.1116
H6	2.1449	1.0848	2.9184	2.0314	3.1116

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.735	C1	C2	H6	125.485
C2	C1	Cl3	121.389	C2	C1	H5	123.014
Cl3	C1	H5	115.597	F4	C2	H6	113.780

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

using model chemistry: wB97X-D/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	-0.348
2	C	0.194
3	Cl	-0.006
4	F	-0.266
5	H	0.233
6	H	0.193

	x	y	z	Total
	0.382	-0.149	0.000	0.410
CHELPG
AIM
ESP

	x	y	z
x	6.900	-0.340	0.000
y	-0.340	4.124	0.000
z	0.000	0.000	2.192

<r²>	124.685
(<r²>)^1/2	11.166