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	hartrees
Energy at 0K	-636.391421
Energy at 298.15K	-636.393603
HF Energy	-635.845010
Nuclear repulsion energy	140.795773

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3341	3104	4.90
2	A'	3333	3097	9.82
3	A'	1815	1687	31.33
4	A'	1385	1287	0.01
5	A'	1310	1217	3.76
6	A'	1218	1131	192.32
7	A'	933	867	57.28
8	A'	473	439	2.32
9	A'	286	266	6.89
10	A"	984	915	65.87
11	A"	864	803	17.67
12	A"	289	268	2.05

Atom	x (Å)	y (Å)
C1	0.000	0.473
C2	1.023	-0.357
Cl3	-1.627	-0.101
F4	2.271	0.102
H5	0.116	1.543
H6	0.958	-1.433

	C1	C2	Cl3	F4	H5	H6
C1		1.3173	1.7250	2.3011	1.0762	2.1329
C2	1.3173		2.6623	1.3292	2.1048	1.0780
Cl3	1.7250	2.6623		3.9029	2.3961	2.9078
F4	2.3011	1.3292	3.9029		2.5920	2.0192
H5	1.0762	2.1048	2.3961	2.5920		3.0922
H6	2.1329	1.0780	2.9078	2.0192	3.0922

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.797	C1	C2	H6	125.577
C2	C1	Cl3	121.535	C2	C1	H5	122.817
Cl3	C1	H5	115.648	F4	C2	H6	113.626

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

using model chemistry: CID/6-311G*

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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