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	hartrees
Energy at 0K	-630.000460
Energy at 298.15K	-630.002457
HF Energy	-630.000460
Nuclear repulsion energy	144.022597

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3572	3188	8.31
2	A'	3410	3043	54.48
3	A'	1818	1622	74.31
4	A'	1524	1360	4.45
5	A'	1314	1173	116.46
6	A'	1019	910	6.72
7	A'	696	621	35.80
8	A'	408	364	0.61
9	A'	348	310	1.52
10	A"	880	785	38.68
11	A"	730	652	0.06
12	A"	507	452	1.39

Atom	x (Å)	y (Å)
C1	0.000	0.507
C2	-1.109	1.269
F3	1.276	0.961
Cl4	-0.100	-1.323
H5	-1.026	2.362
H6	-2.104	0.818

	C1	C2	F3	Cl4	H5	H6
C1		1.3460	1.3549	1.8325	2.1197	2.1273
C2	1.3460		2.4054	2.7818	1.0956	1.0930
F3	1.3549	2.4054		2.6670	2.6945	3.3839
Cl4	1.8325	2.7818	2.6670		3.7992	2.9325
H5	2.1197	1.0956	2.6945	3.7992		1.8837
H6	2.1273	1.0930	3.3839	2.9325	1.8837

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	120.135	C1	C2	H6	121.077
C2	C1	F3	125.889	C2	C1	Cl4	121.376
F3	C1	Cl4	112.736	H5	C2	H6	118.788

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

using model chemistry: B3LYP/STO-3G

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	0.130
2	C	-0.183
3	F	-0.022
4	Cl	-0.130
5	H	0.099
6	H	0.105

	x	y	z	Total
	-0.255	1.753	0.000	1.772
CHELPG
AIM
ESP

	x	y	z
x	2.858	-0.551	0.000
y	-0.551	4.123	0.000
z	0.000	0.000	0.460

<r²>	99.903
(<r²>)^1/2	9.995

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

using model chemistry: B3LYP/STO-3G

States and conformations

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