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	hartrees
Energy at 0K	-636.409892
Energy at 298.15K	-636.411925
HF Energy	-635.787042
Nuclear repulsion energy	139.191922

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3295	3161
2	A'	3289	3156
3	A'	1704	1635
4	A'	1335	1281
5	A'	1272	1221
6	A'	1131	1085
7	A'	893	857
8	A'	446	428
9	A'	272	261
10	A"	899	863
11	A"	761	730
12	A"	265	254

Atom	x (Å)	y (Å)
C1	0.000	0.477
C2	1.020	-0.387
Cl3	-1.642	-0.080
F4	2.300	0.082
H5	0.138	1.548
H6	0.957	-1.467

	C1	C2	Cl3	F4	H5	H6
C1		1.3371	1.7337	2.3334	1.0804	2.1662
C2	1.3371		2.6804	1.3626	2.1271	1.0810
Cl3	1.7337	2.6804		3.9452	2.4120	2.9465
F4	2.3334	1.3626	3.9452		2.6121	2.0492
H5	1.0804	2.1271	2.4120	2.6121		3.1240
H6	2.1662	1.0810	2.9465	2.0492	3.1240

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	119.607	C1	C2	H6	126.908
C2	C1	Cl3	121.041	C2	C1	H5	122.912
Cl3	C1	H5	116.047	F4	C2	H6	113.485

All results from a given calculation for CHFCHCl ((E)-1-chloro-2-fluoroethene)

using model chemistry: CCSD(T)/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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