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	hartrees
Energy at 0K	-634.136873
Energy at 298.15K	-634.139148
HF Energy	-634.136873
Nuclear repulsion energy	146.023024

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3318	3181	3.11
2	A'	3223	3090	11.69
3	A'	1798	1724	120.52
4	A'	1489	1427	3.12
5	A'	1243	1192	180.06
6	A'	1006	964	22.49
7	A'	635	608	58.28
8	A'	415	398	0.39
9	A'	349	335	0.85
10	A"	1002	961	98.00
11	A"	753	722	0.18
12	A"	537	515	0.05

Atom	x (Å)	y (Å)
C1	0.000	0.500
C2	-1.049	1.290
F3	1.290	0.903
Cl4	-0.139	-1.301
H5	-0.910	2.363
H6	-2.047	0.883

	C1	C2	F3	Cl4	H5	H6
C1		1.3127	1.3512	1.8069	2.0727	2.0824
C2	1.3127		2.3700	2.7464	1.0813	1.0783
F3	1.3512	2.3700		2.6269	2.6397	3.3367
Cl4	1.8069	2.7464	2.6269		3.7441	2.9003
H5	2.0727	1.0813	2.6397	3.7441		1.8660
H6	2.0824	1.0783	3.3367	2.9003	1.8660

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.631	C1	C2	H6	120.821
C2	C1	F3	125.655	C2	C1	Cl4	122.585
F3	C1	Cl4	111.761	H5	C2	H6	119.548

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

using model chemistry: M06-2X/3-21G

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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Number	Element	Mulliken
1	C	0.081
2	C	-0.424
3	F	-0.267
4	Cl	0.106
5	H	0.255
6	H	0.249

	x	y	z	Total
	-1.438	1.392	0.000	2.002
CHELPG
AIM
ESP

	x	y	z
x	4.099	-0.798	0.000
y	-0.798	6.171	0.000
z	0.000	0.000	1.366

<r²>	99.112
(<r²>)^1/2	9.956

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

using model chemistry: M06-2X/3-21G

States and conformations

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