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	hartrees
Energy at 0K	-636.597176
Energy at 298.15K	-636.599472
HF Energy	-635.870629
Nuclear repulsion energy	148.965028

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3333	3158	0.05
2	A'	3227	3057	2.47
3	A'	1747	1655	133.91
4	A'	1445	1369	4.01
5	A'	1233	1168	193.78
6	A'	979	928	39.66
7	A'	711	674	41.53
8	A'	441	417	1.78
9	A'	379	359	0.15
10	A"	826	783	57.06
11	A"	729	691	0.21
12	A"	510	483	0.49

Atom	x (Å)	y (Å)
C1	0.000	0.456
C2	-1.001	1.317
F3	1.275	0.842
Cl4	-0.156	-1.269
H5	-0.792	2.376
H6	-2.021	0.972

	C1	C2	F3	Cl4	H5	H6
C1		1.3209	1.3321	1.7315	2.0768	2.0857
C2	1.3209		2.3250	2.7206	1.0789	1.0765
F3	1.3321	2.3250		2.5503	2.5732	3.2981
Cl4	1.7315	2.7206	2.5503		3.6994	2.9151
H5	2.0768	1.0789	2.5732	3.6994		1.8657
H6	2.0857	1.0765	3.2981	2.9151	1.8657

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.523	C1	C2	H6	120.574
C2	C1	F3	122.410	C2	C1	Cl4	125.545
F3	C1	Cl4	112.045	H5	C2	H6	119.903

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

using model chemistry: CCSD=FULL/TZVP

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: CCSD=FULL/TZVP

States and conformations

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