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	hartrees
Energy at 0K	-637.431650
Energy at 298.15K	-637.433953
HF Energy	-637.431650
Nuclear repulsion energy	145.957290

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3260	3116	3.30
2	A'	3237	3093	10.08
3	A'	1753	1676	64.71
4	A'	1365	1305	24.43
5	A'	1268	1212	42.35
6	A'	1100	1051	81.36
7	A'	824	787	17.91
8	A'	670	640	22.12
9	A'	197	189	1.52
10	A"	943	901	0.40
11	A"	787	752	43.79
12	A"	464	443	6.86

Atom	x (Å)	y (Å)
C1	0.000	0.867
C2	1.242	0.425
Cl3	-1.368	-0.172
F4	1.545	-0.870
H5	-0.207	1.924
H6	2.104	1.076

	C1	C2	Cl3	F4	H5	H6
C1		1.3178	1.7178	2.3246	1.0772	2.1145
C2	1.3178		2.6772	1.3302	2.0844	1.0802
Cl3	1.7178	2.6772		2.9957	2.3959	3.6896
F4	2.3246	1.3302	2.9957		3.2978	2.0241
H5	1.0772	2.0844	2.3959	3.2978		2.4621
H6	2.1145	1.0802	3.6896	2.0241	2.4621

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.767	C1	C2	H6	123.411
C2	C1	Cl3	123.214	C2	C1	H5	120.666
Cl3	C1	H5	116.119	F4	C2	H6	113.822

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

using model chemistry: M06-2X/aug-cc-pVTZ

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	-0.351
2	C	-0.170
3	Cl	-0.070
4	F	-0.272
5	H	0.352
6	H	0.511

	x	y	z	Total
	0.842	2.028	0.000	2.196
CHELPG
AIM
ESP

	x	y	z
x	8.069	0.348	0.000
y	0.348	5.661	0.000
z	0.000	0.000	4.429

<r²>	102.825
(<r²>)^1/2	10.140