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	hartrees
Energy at 0K	-636.393703
Energy at 298.15K	-636.395955
HF Energy	-635.788502
Nuclear repulsion energy	144.523317

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3320	3138	5.38
2	A'	3297	3117	6.69
3	A'	1746	1651	53.40
4	A'	1395	1319	26.65
5	A'	1281	1211	22.21
6	A'	1085	1026	101.84
7	A'	830	785	17.98
8	A'	663	627	19.42
9	A'	201	190	1.80
10	A"	878	830	0.08
11	A"	761	720	48.94
12	A"	444	420	7.83

Atom	x (Å)	y (Å)
C1	0.000	0.870
C2	1.257	0.427
Cl3	-1.383	-0.162
F4	1.560	-0.893
H5	-0.202	1.929
H6	2.127	1.067

	C1	C2	Cl3	F4	H5	H6
C1		1.3325	1.7250	2.3537	1.0786	2.1357
C2	1.3325		2.7044	1.3541	2.0938	1.0796
Cl3	1.7250	2.7044		3.0323	2.4013	3.7181
F4	2.3537	1.3541	3.0323		3.3267	2.0397
H5	1.0786	2.0938	2.4013	3.3267		2.4829
H6	2.1357	1.0796	3.7181	2.0397	2.4829

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.339	C1	C2	H6	124.265
C2	C1	Cl3	123.883	C2	C1	H5	120.181
Cl3	C1	H5	115.936	F4	C2	H6	113.396

All results from a given calculation for CHFCHClz ((Z)-1-Chloro-2-fluoroethene)

using model chemistry: QCISD/6-31+G**

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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