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	hartrees
Energy at 0K	-636.514334
Energy at 298.15K	-636.516525
HF Energy	-635.823477
Nuclear repulsion energy	143.503978

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3251	3153
2	A'	3227	3130
3	A'	1692	1641
4	A'	1334	1294
5	A'	1226	1189
6	A'	1048	1017
7	A'	800	776
8	A'	647	628
9	A'	191	185
10	A"	836	811
11	A"	736	714
12	A"	435	422

Atom	x (Å)	y (Å)
C1	0.000	0.880
C2	1.267	0.426
Cl3	-1.392	-0.165
F4	1.569	-0.896
H5	-0.206	1.953
H6	2.145	1.078

	C1	C2	Cl3	F4	H5	H6
C1		1.3459	1.7406	2.3696	1.0917	2.1536
C2	1.3459		2.7236	1.3561	2.1208	1.0929
Cl3	1.7406	2.7236		3.0490	2.4272	3.7483
F4	2.3696	1.3561	3.0490		3.3557	2.0560
H5	1.0917	2.1208	2.4272	3.3557		2.5077
H6	2.1536	1.0929	3.7483	2.0560	2.5077

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	122.563	C1	C2	H6	123.698
C2	C1	Cl3	123.368	C2	C1	H5	120.570
Cl3	C1	H5	116.062	F4	C2	H6	113.740

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

using model chemistry: QCISD(T)=FULL/aug-cc-pVDZ

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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