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	hartrees
Energy at 0K	-637.170834
Energy at 298.15K	-637.165627
HF Energy	-635.777204
Nuclear repulsion energy	141.115617

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3450	3251	3.10
2	A'	3442	3244	11.65
3	A'	1899	1789	38.98
4	A'	1456	1372	0.04
5	A'	1366	1287	6.84
6	A'	1263	1190	211.20
7	A'	951	896	66.49
8	A'	487	459	2.28
9	A'	298	281	8.03
10	A"	1062	1001	48.22
11	A"	936	882	28.06
12	A"	303	286	3.43

Atom	x (Å)	y (Å)
C1	0.000	0.476
C2	1.016	-0.384
Cl3	-1.633	-0.072
F4	2.288	0.066
H5	0.143	1.548
H6	0.933	-1.464

	C1	C2	Cl3	F4	H5	H6
C1		1.3306	1.7227	2.3245	1.0819	2.1528
C2	1.3306		2.6671	1.3494	2.1200	1.0835
Cl3	1.7227	2.6671		3.9237	2.4045	2.9196
F4	2.3245	1.3494	3.9237		2.6075	2.0435
H5	1.0819	2.1200	2.4045	2.6075		3.1143
H6	2.1528	1.0835	2.9196	2.0435	3.1143

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.660	C1	C2	H6	125.902
C2	C1	Cl3	121.595	C2	C1	H5	122.870
Cl3	C1	H5	115.535	F4	C2	H6	113.438

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

using model chemistry: G3

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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