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	hartrees
Energy at 0K	-417.636529
Energy at 298.15K	-417.640997
HF Energy	-417.303876
Nuclear repulsion energy	64.833532

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2475	2380
2	A₁	1301	1251
3	A₁	1154	1109
4	E	2457	2363
4	E	2457	2362
5	E	1129	1085
5	E	1128	1085
6	E	873	840
6	E	873	840

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.387
O2	0.000	0.000	-1.117
H3	0.000	1.257	1.044
H4	-1.089	-0.629	1.044
H5	1.089	-0.629	1.044

	P1	O2	H3	H4	H5
P1		1.5032	1.4190	1.4190	1.4190
O2	1.5032		2.5000	2.5000	2.5000
H3	1.4190	2.5000		2.1780	2.1780
H4	1.4190	2.5000	2.1780		2.1780
H5	1.4190	2.5000	2.1780	2.1780

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	P1	H3	117.604	O2	P1	H4	117.604
O2	P1	H5	117.604	H3	P1	H4	100.251
H3	P1	H5	100.251	H4	P1	H5	100.251

All results from a given calculation for H₃PO (Phosphine oxide)

using model chemistry: MP4=FULL/6-31G*

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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All results from a given calculation for H3PO (Phosphine oxide)

using model chemistry: MP4=FULL/6-31G*

States and conformations

All results from a given calculation for H₃PO (Phosphine oxide)