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	hartrees
Energy at 0K	-637.090208
Energy at 298.15K	-637.092463
HF Energy	-636.900910
Nuclear repulsion energy	144.923211

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3296	3126	8.87
2	A'	3263	3095	3.72
3	A'	1745	1655	54.91
4	A'	1394	1322	25.20
5	A'	1286	1220	27.48
6	A'	1104	1047	84.72
7	A'	825	783	17.67
8	A'	666	631	22.25
9	A'	199	189	1.32
10	A"	890	844	0.04
11	A"	768	728	39.81
12	A"	457	433	8.21

Atom	x (Å)	y (Å)
C1	0.000	0.873
C2	1.251	0.424
Cl3	-1.379	-0.169
F4	1.560	-0.879
H5	-0.211	1.932
H6	2.115	1.076

	C1	C2	Cl3	F4	H5	H6
C1		1.3288	1.7286	2.3457	1.0803	2.1249
C2	1.3288		2.6957	1.3387	2.1009	1.0830
Cl3	1.7286	2.6957		3.0235	2.4042	3.7095
F4	2.3457	1.3387	3.0235		3.3228	2.0319
H5	1.0803	2.1009	2.4042	3.3228		2.4794
H6	2.1249	1.0830	3.7095	2.0319	2.4794

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.127	C1	C2	H6	123.217
C2	C1	Cl3	123.158	C2	C1	H5	121.050
Cl3	C1	H5	115.792	F4	C2	H6	113.656

All results from a given calculation for CHFCHClz ((Z)-1-Chloro-2-fluoroethene)

using model chemistry: B2PLYP=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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