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	hartrees
Energy at 0K	-637.364503
Energy at 298.15K	-637.366790
HF Energy	-637.364503
Nuclear repulsion energy	145.319835

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3281	3281	2.32
2	A'	3260	3260	11.47
3	A'	1761	1761	60.58
4	A'	1352	1352	22.50
5	A'	1253	1253	43.29
6	A'	1088	1088	79.90
7	A'	820	820	19.57
8	A'	668	668	21.37
9	A'	198	198	1.56
10	A"	927	927	0.43
11	A"	784	784	46.31
12	A"	455	455	6.52

Atom	x (Å)	y (Å)
C1	0.000	0.874
C2	1.249	0.429
Cl3	-1.371	-0.174
F4	1.545	-0.875
H5	-0.215	1.938
H6	2.122	1.079

	C1	C2	Cl3	F4	H5	H6
C1		1.3264	1.7259	2.3334	1.0855	2.1314
C2	1.3264		2.6891	1.3367	2.1026	1.0876
Cl3	1.7259	2.6891		2.9990	2.4082	3.7106
F4	2.3334	1.3367	2.9990		3.3178	2.0368
H5	1.0855	2.1026	2.4082	3.3178		2.4892
H6	2.1314	1.0876	3.7106	2.0368	2.4892

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.376	C1	C2	H6	123.704
C2	C1	Cl3	122.997	C2	C1	H5	121.005
Cl3	C1	H5	115.998	F4	C2	H6	113.920

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

using model chemistry: M06-2X/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	-0.068
2	C	1.329
3	Cl	-0.042
4	F	-0.391
5	H	-0.483
6	H	-0.344

	x	y	z	Total
	0.890	2.068	0.000	2.251
CHELPG
AIM
ESP

	x	y	z
x	7.984	0.337	0.000
y	0.337	5.588	0.000
z	0.000	0.000	4.302

<r²>	103.413
(<r²>)^1/2	10.169