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	hartrees
Energy at 0K	-636.571302
Energy at 298.15K	-636.573671
HF Energy	-635.799513
Nuclear repulsion energy	150.305145

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3382	3382	0.90
2	A'	3270	3270	5.78
3	A'	1779	1779	126.38
4	A'	1445	1445	6.06
5	A'	1264	1264	175.41
6	A'	1002	1002	26.13
7	A'	725	725	40.92
8	A'	445	445	1.96
9	A'	379	379	0.13
10	A"	890	890	55.11
11	A"	754	754	0.30
12	A"	560	560	0.15

Atom	x (Å)	y (Å)
C1	0.000	0.455
C2	-1.024	1.286
F3	1.253	0.849
Cl4	-0.133	-1.255
H5	-0.843	2.348
H6	-2.031	0.911

	C1	C2	F3	Cl4	H5	H6
C1		1.3184	1.3129	1.7155	2.0724	2.0817
C2	1.3184		2.3177	2.6929	1.0776	1.0747
F3	1.3129	2.3177		2.5190	2.5768	3.2841
Cl4	1.7155	2.6929	2.5190		3.6729	2.8807
H5	2.0724	1.0776	2.5768	3.6729		1.8644
H6	2.0817	1.0747	3.2841	2.8807	1.8644

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.418	C1	C2	H6	120.541
C2	C1	F3	123.486	C2	C1	Cl4	124.631
F3	C1	Cl4	111.883	H5	C2	H6	120.041

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

using model chemistry: MP3=FULL/6-31G(2df,p)

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

using model chemistry: MP3=FULL/6-31G(2df,p)

States and conformations

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