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	hartrees
Energy at 0K	-757.945721
Energy at 298.15K	-757.946792
HF Energy	-757.945721
Nuclear repulsion energy	124.524057

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1282	1239	147.25
2	Σ	661	639	0.55
3	Π	201	194	4.30
3	Π	201	194	4.30

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	1.458
P2	0.000	0.000	-0.435
O3	0.000	0.000	-1.918

	P1	P2	O3
P1		1.8935	3.3760
P2	1.8935		1.4826
O3	3.3760	1.4826

Number	Element	Mulliken
1	P	-0.112
2	P	0.587
3	O	-0.475

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

using model chemistry: B3LYP/6-311G*

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>	84.544
(<r²>)^1/2	9.195