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	hartrees
Energy at 0K	-573.912790
Energy at 298.15K	-573.908602
HF Energy	-572.781611
Nuclear repulsion energy	89.234059

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3314	3122	32.06
2	A'	2043	1925	446.27
3	A'	1493	1406	61.20
4	A'	827	779	245.02
5	A'	511	482	7.17
6	A"	1071	1009	0.00

Atom	x (Å)	y (Å)
C1	0.000	0.791
O2	1.142	1.157
Cl3	-0.485	-0.908
H4	-0.887	1.434

	C1	O2	Cl3	H4
C1		1.1988	1.7667	1.0956
O2	1.1988		2.6287	2.0474
Cl3	1.7667	2.6287		2.3760
H4	1.0956	2.0474	2.3760

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	Cl3	123.230		O2	C1	H4	126.082
Cl3	C1	H4	110.688

All results from a given calculation for COHCl (Formyl chloride)

using model chemistry: G3

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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