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	hartrees
Energy at 0K	-637.390360
Energy at 298.15K	-637.392632
HF Energy	-637.390360
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3275	3135	6.52
2	A'	3243	3104	6.14
3	A'	1751	1676	64.88
4	A'	1345	1288	24.75
5	A'	1254	1200	35.37
6	A'	1079	1033	97.53
7	A'	818	783	19.88
8	A'	662	633	24.07
9	A'	196	188	1.38
10	A"	910	871	1.43
11	A"	756	724	46.89
12	A"	463	443	6.58

Atom	x (Å)	y (Å)
C1	0.000	0.867
C2	1.252	0.426
Cl3	-1.384	-0.172
F4	1.569	-0.873
H5	-0.211	1.933
H6	2.116	1.088

	C1	C2	Cl3	F4	H5	H6
C1		1.3271	1.7309	2.3431	1.0866	2.1272
C2	1.3271		2.7029	1.3370	2.1001	1.0889
Cl3	1.7309	2.7029		3.0356	2.4100	3.7200
F4	2.3431	1.3370	3.0356		3.3229	2.0360
H5	1.0866	2.1001	2.4100	3.3229		2.4751
H6	2.1272	1.0889	3.7200	2.0360	2.4751

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.163	C1	C2	H6	123.097
C2	C1	Cl3	123.686	C2	C1	H5	120.611
Cl3	C1	H5	115.703	F4	C2	H6	113.740

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

using model chemistry: wB97X-D/aug-cc-pVDZ

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	-0.081
2	C	1.266
3	Cl	-0.141
4	F	-0.395
5	H	-0.397
6	H	-0.252

	x	y	z	Total
	0.912	2.047	0.000	2.241
CHELPG
AIM
ESP

	x	y	z
x	8.074	0.299	0.000
y	0.299	5.637	0.000
z	0.000	0.000	4.378

<r²>	104.539
(<r²>)^1/2	10.224