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	hartrees
Energy at 0K	-636.735749
Energy at 298.15K	-636.730764
HF Energy	-635.774692
Nuclear repulsion energy	145.984834

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3440	3440	10.84
2	A'	3410	3410	3.36
3	A'	1909	1909	73.67
4	A'	1487	1487	34.60
5	A'	1371	1371	42.80
6	A'	1174	1174	118.27
7	A'	876	876	20.22
8	A'	708	708	32.00
9	A'	215	215	1.97
10	A"	1039	1039	0.23
11	A"	856	856	37.09
12	A"	502	502	10.70

Atom	x (Å)	y (Å)
C1	0.000	0.859
C2	1.238	0.427
Cl3	-1.377	-0.182
F4	1.568	-0.847
H5	-0.217	1.910
H6	2.088	1.084

	C1	C2	Cl3	F4	H5	H6
C1		1.3116	1.7265	2.3175	1.0728	2.1004
C2	1.3116		2.6855	1.3161	2.0779	1.0746
Cl3	1.7265	2.6855		3.0195	2.3918	3.6896
F4	2.3175	1.3161	3.0195		3.2846	2.0004
H5	1.0728	2.0779	2.3918	3.2846		2.4489
H6	2.1004	1.0746	3.6896	2.0004	2.4489

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	123.758	C1	C2	H6	123.033
C2	C1	Cl3	123.666	C2	C1	H5	120.927
Cl3	C1	H5	115.407	F4	C2	H6	113.209

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

using model chemistry: CBS-Q

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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