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	hartrees
Energy at 0K	-190.967071
Energy at 298.15K	-190.969431
HF Energy	-190.967071
Nuclear repulsion energy	94.390431

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3493	3143	10.17
2	A'	3460	3114	8.57
3	A'	1873	1685	51.35
4	A'	1461	1315	28.04
5	A'	1353	1218	18.05
6	A'	1102	991	125.44
7	A'	815	733	16.43
8	A'	659	593	36.33
9	A'	209	188	2.53
10	A"	1064	958	0.40
11	A"	859	773	71.20
12	A"	483	435	11.51

Atom	x (Å)	y (Å)
C1	0.000	0.885
C2	1.251	0.476
Cl3	-1.400	-0.212
F4	1.605	-0.846
H5	-0.256	1.921
H6	2.097	1.130

	C1	C2	Cl3	F4	H5	H6
C1		1.3169	1.7788	2.3611	1.0664	2.1113
C2	1.3169		2.7391	1.3681	2.0884	1.0693
Cl3	1.7788	2.7391		3.0714	2.4199	3.7457
F4	2.3611	1.3681	3.0714		3.3345	2.0362
H5	1.0664	2.0884	2.4199	3.3345		2.4826
H6	2.1113	1.0693	3.7457	2.0362	2.4826

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.126	C1	C2	H6	124.130
C2	C1	Cl3	123.773	C2	C1	H5	122.034
Cl3	C1	H5	114.193	F4	C2	H6	112.744

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

using model chemistry: HF/LANL2DZ

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	-0.317
2	C	0.215
3	Cl	-0.054
4	F	-0.321
5	H	0.251
6	H	0.226

	x	y	z	Total
	1.186	3.342	0.000	3.546
CHELPG
AIM
ESP

	x	y	z
x	6.404	0.442	0.000
y	0.442	3.641	0.000
z	0.000	0.000	1.486

<r²>	86.554
(<r²>)^1/2	9.303