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	hartrees
Energy at 0K	-875.806123
Energy at 298.15K
HF Energy	-875.204727
Nuclear repulsion energy	133.335758

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1292	1292	97.07
2	A'	509	509	181.69
3	A'	314	314	4.52

Atom	x (Å)	y (Å)
P1	0.000	0.828
O2	1.464	0.834
Cl3	-0.689	-1.123

	P1	O2	Cl3
P1		1.4644	2.0685
O2	1.4644		2.9094
Cl3	2.0685	2.9094

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

using model chemistry: QCISD/aug-cc-pCVTZ

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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