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	hartrees
Energy at 0K	-668.812052
Energy at 298.15K	-668.812849
HF Energy	-668.384338
Nuclear repulsion energy	149.620709

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1928	1802	280.77
2	A'	1169	1092	357.79
3	A'	756	706	104.21
4	A'	502	469	1.34
5	A'	409	382	2.73
6	A"	675	631	28.39

Atom	x (Å)	y (Å)
C1	0.000	0.506
O2	-0.798	1.389
Cl3	-0.335	-1.203
F4	1.343	0.700

	C1	O2	Cl3	F4
C1		1.1901	1.7407	1.3565
O2	1.1901		2.6322	2.2484
Cl3	1.7407	2.6322		2.5367
F4	1.3565	2.2484	2.5367

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	Cl3	126.804		O2	C1	F4	123.850
Cl3	C1	F4	109.347

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

using model chemistry: CISD/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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