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	hartrees
Energy at 0K	-672.325218
Energy at 298.15K	-672.326046
HF Energy	-671.680605
Nuclear repulsion energy	150.720702

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1969	1866	378.87
2	A'	1164	1103	431.49
3	A'	778	737	83.14
4	A'	509	482	0.59
5	A'	414	393	1.24
6	A"	682	646	20.72

Atom	x (Å)	y (Å)
C1	0.000	0.511
O2	-0.813	1.366
Cl3	-0.312	-1.206
F4	1.312	0.723

	C1	O2	Cl3	F4
C1		1.1797	1.7447	1.3288
O2	1.1797		2.6199	2.2199
Cl3	1.7447	2.6199		2.5209
F4	1.3288	2.2199	2.5209

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	Cl3	126.150		O2	C1	F4	124.382
Cl3	C1	F4	109.468

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

using model chemistry: CCSD/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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