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	hartrees
Energy at 0K	-28.982278
Energy at 298.15K	-28.983280
HF Energy	-28.982278
Nuclear repulsion energy	22.022669

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1232	1194	143.29
2	Σ	642	622	1.49
3	Π	183	178	2.44
3	Π	183	178	2.44

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	1.485
P2	0.000	0.000	-0.445
O3	0.000	0.000	-1.950

	P1	P2	O3
P1		1.9294	3.4350
P2	1.9294		1.5056
O3	3.4350	1.5056

Number	Element	Mulliken
1	P	-0.105
2	P	0.422
3	O	-0.318

All results from a given calculation for PPO (Phosphorus oxide phosphide)

using model chemistry: B3LYP/CEP-121G*

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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<r²>	53.430
(<r²>)^1/2	7.310