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	hartrees
Energy at 0K	-636.387618
Energy at 298.15K	-636.389739
HF Energy	-635.780125
Nuclear repulsion energy	140.144026

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3350	3350	6.83
2	A'	3335	3335	5.61
3	A'	1784	1784	19.82
4	A'	1374	1374	0.16
5	A'	1292	1292	7.89
6	A'	1201	1201	152.19
7	A'	919	919	44.96
8	A'	461	461	1.94
9	A'	278	278	6.94
10	A"	955	955	52.62
11	A"	813	813	10.23
12	A"	280	280	2.35

Atom	x (Å)	y (Å)
C1	0.000	0.473
C2	1.021	-0.373
Cl3	-1.633	-0.087
F4	2.284	0.088
H5	0.133	1.540
H6	0.948	-1.448

	C1	C2	Cl3	F4	H5	H6
C1		1.3260	1.7265	2.3163	1.0752	2.1423
C2	1.3260		2.6690	1.3451	2.1097	1.0772
Cl3	1.7265	2.6690		3.9210	2.4013	2.9174
F4	2.3163	1.3451	3.9210		2.5958	2.0362
H5	1.0752	2.1097	2.4013	2.5958		3.0975
H6	2.1423	1.0772	2.9174	2.0362	3.0975

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	120.261	C1	C2	H6	125.790
C2	C1	Cl3	121.379	C2	C1	H5	122.595
Cl3	C1	H5	116.025	F4	C2	H6	113.949

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

using model chemistry: MP3=FULL/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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