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	hartrees
Energy at 0K	-635.369575
Energy at 298.15K	-635.371786
HF Energy	-635.369575
Nuclear repulsion energy	149.631017

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3249	3188	1.12
2	A'	3146	3087	8.85
3	A'	1730	1698	159.35
4	A'	1362	1336	11.61
5	A'	1218	1195	204.48
6	A'	945	927	19.64
7	A'	694	681	47.30
8	A'	428	420	0.97
9	A'	365	359	0.10
10	A"	788	773	75.22
11	A"	698	685	0.14
12	A"	530	520	0.36

Atom	x (Å)	y (Å)
C1	0.000	0.454
C2	-1.024	1.296
F3	1.260	0.846
Cl4	-0.136	-1.260
H5	-0.831	2.372
H6	-2.050	0.929

	C1	C2	F3	Cl4	H5	H6
C1		1.3256	1.3190	1.7197	2.0896	2.1046
C2	1.3256		2.3276	2.7060	1.0924	1.0899
F3	1.3190	2.3276		2.5261	2.5884	3.3110
Cl4	1.7197	2.7060	2.5261		3.6974	2.9082
H5	2.0896	1.0924	2.5884	3.6974		1.8884
H6	2.1046	1.0899	3.3110	2.9082	1.8884

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.259	C1	C2	H6	120.906
C2	C1	F3	123.319	C2	C1	Cl4	124.890
F3	C1	Cl4	111.791	H5	C2	H6	119.836

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

using model chemistry: LSDA/6-31G*

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	0.190
2	C	-0.437
3	F	-0.180
4	Cl	0.029
5	H	0.198
6	H	0.200

	x	y	z	Total
	-0.854	0.765	0.000	1.147
CHELPG
AIM
ESP

	x	y	z
x	4.725	-0.828	0.000
y	-0.828	6.618	0.000
z	0.000	0.000	2.216

<r²>	94.738
(<r²>)^1/2	9.733

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

using model chemistry: LSDA/6-31G*

States and conformations

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