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	hartrees
Energy at 0K	-672.264663
Energy at 298.15K	-672.265472
HF Energy	-671.642734
Nuclear repulsion energy	150.670474

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1952	1859	343.95
2	A'	1170	1114	410.86
3	A'	777	740	77.32
4	A'	509	485	0.88
5	A'	416	396	1.16
6	A"	671	639	22.95

Atom	x (Å)	y (Å)
C1	0.000	0.504
O2	-0.812	1.368
Cl3	-0.316	-1.201
F4	1.319	0.717

	C1	O2	Cl3	F4
C1		1.1857	1.7340	1.3360
O2	1.1857		2.6167	2.2280
Cl3	1.7340	2.6167		2.5202
F4	1.3360	2.2280	2.5202

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	Cl3	126.297		O2	C1	F4	124.029
Cl3	C1	F4	109.674

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

using model chemistry: QCISD/6-31G*

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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