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	hartrees
Energy at 0K	-875.621664
Energy at 298.15K	-875.622568
HF Energy	-875.132953
Nuclear repulsion energy	129.957591

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1187	1150	92.79
2	A'	482	467	175.44
3	A'	294	285	4.16

Atom	x (Å)	y (Å)
P1	0.000	0.854
O2	1.506	0.836
Cl3	-0.709	-1.147

	P1	O2	Cl3
P1		1.5062	2.1221
O2	1.5062		2.9726
Cl3	2.1221	2.9726

All results from a given calculation for OPCl (Phosphorus oxychloride)

using model chemistry: QCISD/aug-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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