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	hartrees
Energy at 0K	-633.196216
Energy at 298.15K	-633.198480
HF Energy	-632.735262
Nuclear repulsion energy	143.513651

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3248	3122	7.62
2	A'	3209	3084	2.24
3	A'	1718	1651	25.44
4	A'	1424	1369	12.22
5	A'	1303	1252	7.00
6	A'	1079	1037	51.44
7	A'	798	767	10.06
8	A'	651	625	21.42
9	A'	196	189	1.79
10	A"	946	909	0.34
11	A"	785	754	43.00
12	A"	460	442	8.87

Atom	x (Å)	y (Å)
C1	0.000	0.899
C2	1.251	0.440
Cl3	-1.379	-0.173
F4	1.560	-0.905
H5	-0.220	1.959
H6	2.117	1.095

	C1	C2	Cl3	F4	H5	H6
C1		1.3324	1.7466	2.3846	1.0829	2.1258
C2	1.3324		2.7004	1.3800	2.1144	1.0853
Cl3	1.7466	2.7004		3.0281	2.4271	3.7184
F4	2.3846	1.3800	3.0281		3.3719	2.0757
H5	1.0829	2.1144	2.4271	3.3719		2.4914
H6	2.1258	1.0853	3.7184	2.0757	2.4914

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.060	C1	C2	H6	122.773
C2	C1	Cl3	121.992	C2	C1	H5	121.850
Cl3	C1	H5	116.158	F4	C2	H6	114.166

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

using model chemistry: QCISD/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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