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	hartrees
Energy at 0K	-572.964827
Energy at 298.15K	-572.965846
HF Energy	-572.689367
Nuclear repulsion energy	83.914756

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3191	3053	18.30
2	A'	1665	1593	302.68
3	A'	1353	1294	60.26
4	A'	641	613	221.48
5	A'	393	376	37.68
6	A"	920	880	5.40

Atom	x (Å)	y (Å)
C1	0.000	0.862
O2	1.161	1.237
Cl3	-0.492	-0.972
H4	-0.914	1.456

	C1	O2	Cl3	H4
C1		1.2200	1.8990	1.0905
O2	1.2200		2.7596	2.0864
Cl3	1.8990	2.7596		2.4648
H4	1.0905	2.0864	2.4648

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	C1	Cl3	122.961		O2	C1	H4	129.035
Cl3	C1	H4	108.004

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

using model chemistry: MP2/6-31G

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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