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	hartrees
Energy at 0K	-668.620532
Energy at 298.15K	-668.621214
HF Energy	-668.269787
Nuclear repulsion energy	146.231927

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1971	1837	298.41
2	A'	1161	1081	366.35
3	A'	718	669	133.71
4	A'	446	415	5.90
5	A'	370	345	4.19
6	A"	638	594	29.71

Atom	x (Å)	y (Å)
C1	0.000	0.563
O2	-0.827	1.409
Cl3	-0.317	-1.262
F4	1.333	0.757

	C1	O2	Cl3	F4
C1		1.1827	1.8523	1.3473
O2	1.1827		2.7191	2.2559
Cl3	1.8523	2.7191		2.6077
F4	1.3473	2.2559	2.6077

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	Cl3	125.810		O2	C1	F4	126.047
Cl3	C1	F4	108.143

All results from a given calculation for COFCl (Carbonic chloride fluoride)

using model chemistry: CID/3-21G

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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