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	hartrees
Energy at 0K	-637.164880
Energy at 298.15K	-637.167152
HF Energy	-636.953764
Nuclear repulsion energy	148.271525

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3328	3201	0.43
2	A'	3212	3090	4.38
3	A'	1711	1646	151.39
4	A'	1398	1345	1.19
5	A'	1176	1131	177.93
6	A'	944	908	49.99
7	A'	695	669	43.51
8	A'	427	411	1.38
9	A'	369	355	0.03
10	A"	867	834	56.84
11	A"	718	691	0.13
12	A"	520	500	1.80

Atom	x (Å)	y (Å)
C1	0.000	0.455
C2	-0.995	1.339
F3	1.295	0.822
Cl4	-0.170	-1.268
H5	-0.766	2.402
H6	-2.024	0.999

	C1	C2	F3	Cl4	H5	H6
C1		1.3307	1.3458	1.7317	2.0918	2.0962
C2	1.3307		2.3472	2.7345	1.0870	1.0846
F3	1.3458	2.3472		2.5525	2.5964	3.3240
Cl4	1.7317	2.7345	2.5525		3.7179	2.9288
H5	2.0918	1.0870	2.5964	3.7179		1.8848
H6	2.0962	1.0846	3.3240	2.9288	1.8848

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.466	C1	C2	H6	120.087
C2	C1	F3	122.555	C2	C1	Cl4	125.986
F3	C1	Cl4	111.459	H5	C2	H6	120.448

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

using model chemistry: B2PLYP=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: B2PLYP=FULL/aug-cc-pVDZ

States and conformations

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