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	hartrees
Energy at 0K	-637.449518
Energy at 298.15K	-637.451793
HF Energy	-637.449518
Nuclear repulsion energy	145.437219

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3268	3119	10.09
2	A'	3233	3086	3.85
3	A'	1752	1672	66.29
4	A'	1374	1311	26.65
5	A'	1279	1220	38.51
6	A'	1102	1052	103.71
7	A'	826	788	19.62
8	A'	671	640	24.59
9	A'	198	189	1.36
10	A"	899	858	0.01
11	A"	761	726	53.71
12	A"	467	445	11.39

Atom	x (Å)	y (Å)
C1	0.000	0.862
C2	1.245	0.417
Cl3	-1.380	-0.167
F4	1.567	-0.870
H5	-0.213	1.920
H6	2.104	1.077

	C1	C2	Cl3	F4	H5	H6
C1		1.3220	1.7214	2.3348	1.0796	2.1149
C2	1.3220		2.6896	1.3267	2.0935	1.0830
Cl3	1.7214	2.6896		3.0292	2.3915	3.6996
F4	2.3348	1.3267	3.0292		3.3088	2.0198
H5	1.0796	2.0935	2.3915	3.3088		2.4651
H6	2.1149	1.0830	3.6996	2.0198	2.4651

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.650	C1	C2	H6	122.833
C2	C1	Cl3	123.666	C2	C1	H5	120.991
Cl3	C1	H5	115.343	F4	C2	H6	113.517

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

using model chemistry: mPW1PW91/6-311G*

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	-0.409
2	C	0.109
3	Cl	-0.015
4	F	-0.192
5	H	0.278
6	H	0.229

	x	y	z	Total
	1.061	2.022	0.000	2.283
CHELPG
AIM
ESP

	x	y	z
x	6.965	0.503	0.000
y	0.503	4.341	0.000
z	0.000	0.000	2.351

<r²>	103.801
(<r²>)^1/2	10.188