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	hartrees
Energy at 0K	-636.404401
Energy at 298.15K	-636.406504
HF Energy	-635.788223
Nuclear repulsion energy	139.954644

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3344	3115	1.85
2	A'	3338	3110	11.17
3	A'	1766	1645	19.84
4	A'	1362	1269	0.03
5	A'	1294	1206	7.45
6	A'	1168	1088	176.73
7	A'	916	853	49.55
8	A'	458	427	1.93
9	A'	278	259	7.26
10	A"	935	871	70.50
11	A"	810	754	5.17
12	A"	275	256	1.73

Atom	x (Å)	y (Å)
C1	0.000	0.473
C2	1.018	-0.379
Cl3	-1.634	-0.085
F4	2.287	0.088
H5	0.135	1.540
H6	0.955	-1.454

	C1	C2	Cl3	F4	H5	H6
C1		1.3272	1.7266	2.3192	1.0759	2.1510
C2	1.3272		2.6679	1.3529	2.1128	1.0770
Cl3	1.7266	2.6679		3.9250	2.4019	2.9292
F4	2.3192	1.3529	3.9250		2.5965	2.0380
H5	1.0759	2.1128	2.4019	2.5965		3.1051
H6	2.1510	1.0770	2.9292	2.0380	3.1051

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	119.843	C1	C2	H6	126.628
C2	C1	Cl3	121.216	C2	C1	H5	122.755
Cl3	C1	H5	116.029	F4	C2	H6	113.529

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

using model chemistry: MP3=FULL/6-31+G**

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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