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	hartrees
Energy at 0K	-417.658271
Energy at 298.15K	-417.662766
HF Energy	-417.317943
Nuclear repulsion energy	65.523402

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2568	2392	88.77
2	A₁	1304	1214	301.04
3	A₁	1204	1121	4.15
4	E	2556	2381	118.23
4	E	2556	2381	118.23
5	E	1181	1101	47.97
5	E	1181	1101	47.97
6	E	881	820	34.48
6	E	881	820	34.48

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.386
O2	0.000	0.000	-1.105
H3	0.000	1.248	1.018
H4	-1.081	-0.624	1.018
H5	1.081	-0.624	1.018

	P1	O2	H3	H4	H5
P1		1.4904	1.3988	1.3988	1.3988
O2	1.4904		2.4620	2.4620	2.4620
H3	1.3988	2.4620		2.1616	2.1616
H4	1.3988	2.4620	2.1616		2.1616
H5	1.3988	2.4620	2.1616	2.1616

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	P1	H3	116.854	O2	P1	H4	116.854
O2	P1	H5	116.854	H3	P1	H4	101.182
H3	P1	H5	101.182	H4	P1	H5	101.182

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

using model chemistry: MP3=FULL/6-31+G**

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: MP3=FULL/6-31+G**

States and conformations

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