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	hartrees
Energy at 0K	-634.296729
Energy at 298.15K	-634.299061
HF Energy	-634.296729
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3338	3164	0.85
2	A'	3238	3069	7.98
3	A'	1766	1674	127.36
4	A'	1487	1409	1.60
5	A'	1249	1184	165.97
6	A'	995	944	27.63
7	A'	681	646	51.28
8	A'	429	406	0.79
9	A'	380	360	0.33
10	A"	964	914	104.51
11	A"	736	697	0.68
12	A"	555	526	0.60

Atom	x (Å)	y (Å)
C1	0.000	0.463
C2	-1.030	1.284
F3	1.294	0.868
Cl4	-0.151	-1.268
H5	-0.865	2.353
H6	-2.040	0.905

	C1	C2	F3	Cl4	H5	H6
C1		1.3176	1.3560	1.7369	2.0789	2.0873
C2	1.3176		2.3608	2.6994	1.0812	1.0789
F3	1.3560	2.3608		2.5786	2.6203	3.3340
Cl4	1.7369	2.6994	2.5786		3.6905	2.8791
H5	2.0789	1.0812	2.6203	3.6905		1.8647
H6	2.0873	1.0789	3.3340	2.8791	1.8647

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.820	C1	C2	H6	120.814
C2	C1	F3	124.004	C2	C1	Cl4	123.612
F3	C1	Cl4	112.384	H5	C2	H6	119.366

All results from a given calculation for C₂H₂ClF (1-chloro-1-fluoroethylene)

using model chemistry: wB97X-D/3-21G*

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	0.185
2	C	-0.483
3	F	-0.269
4	Cl	0.051
5	H	0.261
6	H	0.255

	x	y	z	Total
	-1.322	0.883	0.000	1.590
CHELPG
AIM
ESP

	x	y	z
x	4.378	-0.833	0.000
y	-0.833	6.049	0.000
z	0.000	0.000	1.676

<r²>	96.325
(<r²>)^1/2	9.815

All results from a given calculation for C2H2ClF (1-chloro-1-fluoroethylene)

using model chemistry: wB97X-D/3-21G*

States and conformations

All results from a given calculation for C₂H₂ClF (1-chloro-1-fluoroethylene)