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	hartrees
Energy at 0K	-636.487992
Energy at 298.15K	-636.490287
HF Energy	-635.826034
Nuclear repulsion energy	148.263597

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3345	3345	0.15
2	A'	3231	3231	3.42
3	A'	1744	1744	131.83
4	A'	1415	1415	2.07
5	A'	1213	1213	174.23
6	A'	963	963	40.59
7	A'	708	708	39.66
8	A'	433	433	2.04
9	A'	370	370	0.03
10	A"	877	877	53.20
11	A"	727	727	0.22
12	A"	516	516	1.23

Atom	x (Å)	y (Å)
C1	0.000	0.453
C2	-1.002	1.335
F3	1.290	0.829
Cl4	-0.164	-1.269
H5	-0.776	2.401
H6	-2.032	0.990

	C1	C2	F3	Cl4	H5	H6
C1		1.3347	1.3432	1.7303	2.0961	2.1019
C2	1.3347		2.3469	2.7359	1.0892	1.0869
F3	1.3432	2.3469		2.5523	2.5955	3.3259
Cl4	1.7303	2.7359	2.5523		3.7205	2.9314
H5	2.0961	1.0892	2.5955	3.7205		1.8895
H6	2.1019	1.0869	3.3259	2.9314	1.8895

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.372	C1	C2	H6	120.104
C2	C1	F3	122.414	C2	C1	Cl4	125.920
F3	C1	Cl4	111.666	H5	C2	H6	120.524

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

using model chemistry: MP3=FULL/aug-cc-pVDZ

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/aug-cc-pVDZ

States and conformations

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