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	hartrees
Energy at 0K	-637.134912
Energy at 298.15K	-637.137202
HF Energy	-636.937703
Nuclear repulsion energy	148.553107

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3334	3195	0.44
2	A'	3216	3082	4.72
3	A'	1731	1659	153.84
4	A'	1397	1339	3.90
5	A'	1212	1161	193.63
6	A'	962	922	37.77
7	A'	696	667	47.70
8	A'	432	414	1.18
9	A'	373	358	0.14
10	A"	845	810	54.93
11	A"	725	695	0.21
12	A"	538	516	0.21

Atom	x (Å)	y (Å)
C1	0.000	0.458
C2	-1.022	1.310
F3	1.275	0.849
Cl4	-0.146	-1.269
H5	-0.819	2.380
H6	-2.045	0.944

	C1	C2	F3	Cl4	H5	H6
C1		1.3307	1.3337	1.7337	2.0889	2.1019
C2	1.3307		2.3436	2.7241	1.0890	1.0863
F3	1.3337	2.3436		2.5506	2.5945	3.3218
Cl4	1.7337	2.7241	2.5506		3.7107	2.9160
H5	2.0889	1.0890	2.5945	3.7107		1.8884
H6	2.1019	1.0863	3.3218	2.9160	1.8884

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.041	C1	C2	H6	120.490
C2	C1	F3	123.184	C2	C1	Cl4	124.968
F3	C1	Cl4	111.848	H5	C2	H6	120.469

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

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

States and conformations

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