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	hartrees
Energy at 0K	-664.001762
Energy at 298.15K	-664.002275
HF Energy	-663.838275
Nuclear repulsion energy	143.718373

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1893	1683	89.33
2	A'	1245	1106	230.49
3	A'	733	651	104.62
4	A'	466	414	0.70
5	A'	373	332	5.51
6	A"	572	508	14.61

Atom	x (Å)	y (Å)
C1	0.000	0.558
O2	-0.898	1.413
Cl3	-0.286	-1.282
F4	1.338	0.792

	C1	O2	Cl3	F4
C1		1.2398	1.8617	1.3584
O2	1.2398		2.7633	2.3203
Cl3	1.8617	2.7633		2.6341
F4	1.3584	2.3203	2.6341

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	Cl3	124.774		O2	C1	F4	126.461
Cl3	C1	F4	108.765

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

using model chemistry: MP2=FULL/STO-3G

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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