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	hartrees
Energy at 0K	-573.249620
Energy at 298.15K	-573.250768
HF Energy	-572.778738
Nuclear repulsion energy	87.604996

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3101	2975
2	A'	1817	1744
3	A'	1387	1331
4	A'	765	734
5	A'	466	447
6	A"	950	912

Atom	x (Å)	y (Å)
C1	0.000	0.796
O2	1.142	1.161
Cl3	-0.486	-0.912
H4	-0.886	1.446

	C1	O2	Cl3	H4
C1		1.1993	1.7754	1.0993
O2	1.1993		2.6355	2.0486
Cl3	1.7754	2.6355		2.3921
H4	1.0993	2.0486	2.3921

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	Cl3	123.580		O2	C1	H4	126.006
Cl3	C1	H4	110.414

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

using model chemistry: QCISD(T)/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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