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	hartrees
Energy at 0K	-636.343540
Energy at 298.15K	-636.345636
HF Energy	-635.779545
Nuclear repulsion energy	139.943073

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3332	3120	7.71
2	A'	3318	3107	5.75
3	A'	1740	1630	20.10
4	A'	1358	1272	0.02
5	A'	1279	1198	7.90
6	A'	1182	1107	147.37
7	A'	918	859	46.03
8	A'	457	428	1.85
9	A'	275	257	6.42
10	A"	944	884	53.62
11	A"	790	740	10.30
12	A"	278	261	1.92

Atom	x (Å)	y (Å)
C1	0.000	0.475
C2	1.017	-0.385
Cl3	-1.634	-0.071
F4	2.289	0.065
H5	0.146	1.543
H6	0.932	-1.461

	C1	C2	Cl3	F4	H5	H6
C1		1.3318	1.7232	2.3258	1.0779	2.1491
C2	1.3318		2.6695	1.3500	2.1158	1.0797
Cl3	1.7232	2.6695		3.9260	2.4032	2.9184
F4	2.3258	1.3500	3.9260		2.6035	2.0431
H5	1.0779	2.1158	2.4032	2.6035		3.1057
H6	2.1491	1.0797	2.9184	2.0431	3.1057

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.277	C1	C2	H6	125.720
C2	C1	Cl3	121.278	C2	C1	H5	122.453
Cl3	C1	H5	116.269	F4	C2	H6	114.003

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

using model chemistry: MP2/6-31G**

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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