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	hartrees
Energy at 0K	-51.224122
Energy at 298.15K	-51.226144
HF Energy	-50.655315
Nuclear repulsion energy	56.152592

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3274	3119	1.26
2	A'	3267	3113	12.41
3	A'	1673	1594	22.27
4	A'	1322	1260	0.50
5	A'	1253	1194	4.95
6	A'	1141	1087	176.78
7	A'	903	860	51.99
8	A'	449	427	1.89
9	A'	269	257	7.05
10	A"	897	854	79.77
11	A"	728	693	6.95
12	A"	268	255	1.41

Atom	x (Å)	y (Å)
C1	0.000	0.490
C2	1.022	-0.382
Cl3	-1.644	-0.087
F4	2.303	0.080
H5	0.134	1.566
H6	0.950	-1.464

	C1	C2	Cl3	F4	H5	H6
C1		1.3430	1.7418	2.3391	1.0841	2.1733
C2	1.3430		2.6815	1.3617	2.1403	1.0852
Cl3	1.7418	2.6815		3.9499	2.4269	2.9371
F4	2.3391	1.3617	3.9499		2.6293	2.0527
H5	1.0841	2.1403	2.4269	2.6293		3.1384
H6	2.1733	1.0852	2.9371	2.0527	3.1384

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	119.724	C1	C2	H6	126.700
C2	C1	Cl3	120.195	C2	C1	H5	123.377
Cl3	C1	H5	116.428	F4	C2	H6	113.576

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

using model chemistry: MP2/CEP-121G*

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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