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	hartrees
Energy at 0K	-758.010184
Energy at 298.15K	-758.011352
HF Energy	-758.010184
Nuclear repulsion energy	125.386877

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1333	1275	146.64
2	Σ	689	659	1.50
3	Π	227	217	3.35
3	Π	227	217	3.35

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	1.449
P2	0.000	0.000	-0.433
O3	0.000	0.000	-1.904

	P1	P2	O3
P1		1.8815	3.3527
P2	1.8815		1.4712
O3	3.3527	1.4712

Number	Element	Mulliken
1	P	-0.147
2	P	0.506
3	O	-0.359

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

using model chemistry: B1B95/cc-pVTZ

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>	82.735
(<r²>)^1/2	9.096