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	hartrees
Energy at 0K	-190.965689
Energy at 298.15K	-190.968080
HF Energy	-190.965689
Nuclear repulsion energy	95.844087

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3503	3153	0.34
2	A'	3385	3046	3.09
3	A'	1871	1684	159.73
4	A'	1555	1399	1.01
5	A'	1281	1153	194.71
6	A'	1019	917	63.37
7	A'	693	624	53.36
8	A'	436	393	2.12
9	A'	380	342	1.70
10	A"	1106	995	97.25
11	A"	803	723	0.67
12	A"	546	492	0.35

Atom	x (Å)	y (Å)
C1	0.000	0.475
C2	-0.974	1.357
F3	1.319	0.823
Cl4	-0.193	-1.285
H5	-0.745	2.404
H6	-1.997	1.050

	C1	C2	F3	Cl4	H5	H6
C1		1.3141	1.3642	1.7708	2.0683	2.0784
C2	1.3141		2.3540	2.7555	1.0716	1.0687
F3	1.3642	2.3540		2.5948	2.5999	3.3239
Cl4	1.7708	2.7555	2.5948		3.7307	2.9509
H5	2.0683	1.0716	2.5999	3.7307		1.8446
H6	2.0784	1.0687	3.3239	2.9509	1.8446

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.864	C1	C2	H6	121.095
C2	C1	F3	123.015	C2	C1	Cl4	125.922
F3	C1	Cl4	111.063	H5	C2	H6	119.041

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

using model chemistry: HF/LANL2DZ

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	0.267
2	C	-0.399
3	F	-0.298
4	Cl	-0.037
5	H	0.235
6	H	0.231

	x	y	z	Total
	-2.110	1.425	0.000	2.546
CHELPG
AIM
ESP

	x	y	z
x	4.001	-0.940	0.000
y	-0.940	6.133	0.000
z	0.000	0.000	1.584

<r²>	81.277
(<r²>)^1/2	9.015

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

using model chemistry: HF/LANL2DZ

States and conformations

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