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	hartrees
Energy at 0K	-635.890720
Energy at 298.15K	-635.893231
HF Energy	-635.890720
Nuclear repulsion energy	150.885591

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3427	3120	0.15
2	A'	3325	3027	3.22
3	A'	1863	1696	190.82
4	A'	1528	1391	5.52
5	A'	1318	1200	193.52
6	A'	1054	959	46.80
7	A'	753	685	49.35
8	A'	470	428	1.51
9	A'	400	364	0.03
10	A"	1009	918	63.69
11	A"	799	728	0.13
12	A"	594	540	2.10

Atom	x (Å)	y (Å)
C1	0.000	0.457
C2	-0.993	1.301
F3	1.252	0.830
Cl4	-0.148	-1.254
H5	-0.792	2.353
H6	-2.003	0.951

	C1	C2	F3	Cl4	H5	H6
C1		1.3040	1.3064	1.7171	2.0555	2.0629
C2	1.3040		2.2941	2.6919	1.0712	1.0682
F3	1.3064	2.2941		2.5106	2.5489	3.2567
Cl4	1.7171	2.6919	2.5106		3.6647	2.8819
H5	2.0555	1.0712	2.5489	3.6647		1.8526
H6	2.0629	1.0682	3.2567	2.8819	1.8526

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.531	C1	C2	H6	120.494
C2	C1	F3	123.005	C2	C1	Cl4	125.443
F3	C1	Cl4	111.551	H5	C2	H6	119.975

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

using model chemistry: HF/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	0.626
2	C	-1.103
3	F	-0.268
4	Cl	-0.162
5	H	0.413
6	H	0.495

	x	y	z	Total
	-1.261	0.804	0.000	1.496
CHELPG
AIM
ESP

	x	y	z
x	5.744	-0.977	0.000
y	-0.977	7.363	0.000
z	0.000	0.000	4.300

<r²>	94.028
(<r²>)^1/2	9.697

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

using model chemistry: HF/aug-cc-pVTZ

States and conformations

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