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	hartrees
Energy at 0K	-635.777204
Energy at 298.15K	-635.779464
HF Energy	-635.777204
Nuclear repulsion energy	141.114559

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3450	3100	3.10
2	A'	3442	3093	11.65
3	A'	1899	1706	38.98
4	A'	1456	1308	0.04
5	A'	1366	1228	6.84
6	A'	1263	1135	211.20
7	A'	951	855	66.49
8	A'	487	437	2.28
9	A'	298	268	8.03
10	A"	1062	954	48.22
11	A"	936	841	28.06
12	A"	303	272	3.43

Atom	x (Å)	y (Å)
C1	0.000	0.470
C2	1.027	-0.342
Cl3	-1.624	-0.123
F4	2.263	0.133
H5	0.102	1.536
H6	0.981	-1.412

	C1	C2	Cl3	F4	H5	H6
C1		1.3089	1.7289	2.2879	1.0704	2.1222
C2	1.3089		2.6596	1.3242	2.0928	1.0708
Cl3	1.7289	2.6596		3.8953	2.3938	2.9063
F4	2.2879	1.3242	3.8953		2.5763	2.0071
H5	1.0704	2.0928	2.3938	2.5763		3.0756
H6	2.1222	1.0708	2.9063	2.0071	3.0756

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.660	C1	C2	H6	125.902
C2	C1	Cl3	121.595	C2	C1	H5	122.870
Cl3	C1	H5	115.535	F4	C2	H6	113.438

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

using model chemistry: HF/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	-0.374
2	C	0.277
3	Cl	-0.016
4	F	-0.354
5	H	0.252
6	H	0.215

	x	y	z	Total
	0.310	-0.231	0.000	0.386
CHELPG
AIM
ESP

	x	y	z
x	6.602	-0.424	0.000
y	-0.424	4.002	0.000
z	0.000	0.000	2.145

<r²>	123.770
(<r²>)^1/2	11.125