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	hartrees
Energy at 0K	-636.743445
Energy at 298.15K	-636.745762
HF Energy	-635.885547
Nuclear repulsion energy	145.844115

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3298	3127	6.44
2	A'	3260	3091	5.42
3	A'	1768	1676	58.17
4	A'	1398	1325	22.85
5	A'	1294	1227	37.79
6	A'	1111	1053	81.37
7	A'	834	790	15.14
8	A'	674	639	20.30
9	A'	201	190	1.47
10	A"	927	879	0.12
11	A"	788	747	40.88
12	A"	467	443	7.10

Atom	x (Å)	y (Å)
C1	0.000	0.863
C2	1.244	0.421
Cl3	-1.374	-0.169
F4	1.556	-0.869
H5	-0.200	1.915
H6	2.095	1.075

	C1	C2	Cl3	F4	H5	H6
C1		1.3201	1.7184	2.3276	1.0705	2.1056
C2	1.3201		2.6835	1.3264	2.0773	1.0736
Cl3	1.7184	2.6835		3.0119	2.3919	3.6854
F4	2.3276	1.3264	3.0119		3.2903	2.0172
H5	1.0705	2.0773	2.3919	3.2903		2.4432
H6	2.1056	1.0736	3.6854	2.0172	2.4432

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.160	C1	C2	H6	122.866
C2	C1	Cl3	123.519	C2	C1	H5	120.316
Cl3	C1	H5	116.165	F4	C2	H6	113.974

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

using model chemistry: CCSD=FULL/cc-pVTZ

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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