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	hartrees
Energy at 0K	-1794.774431
Energy at 298.15K	-1794.776397
HF Energy	-1794.088177
Nuclear repulsion energy	462.836012

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1319	1244	130.45
2	A₁	493	465	23.36
3	A₁	279	264	4.11
4	E	614	579	259.08
4	E	614	579	259.08
5	E	336	317	12.52
5	E	336	317	12.52
6	E	191	180	0.02
6	E	191	180	0.02

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.424
O2	0.000	0.000	1.901
Cl3	0.000	1.823	-0.423
Cl4	1.579	-0.911	-0.423
Cl5	-1.579	-0.911	-0.423

	P1	O2	Cl3	Cl4	Cl5
P1		1.4771	2.0098	2.0098	2.0098
O2	1.4771		2.9533	2.9533	2.9533
Cl3	2.0098	2.9533		3.1572	3.1572
Cl4	2.0098	2.9533	3.1572		3.1572
Cl5	2.0098	2.9533	3.1572	3.1572

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	P1	Cl3	114.910	O2	P1	Cl4	114.910
O2	P1	Cl5	114.910	Cl3	P1	Cl4	103.527
Cl3	P1	Cl5	103.527	Cl4	P1	Cl5	103.527

All results from a given calculation for Cl₃PO (Phosphoryl chloride)

using model chemistry: MP2/6-31G*

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 Cl3PO (Phosphoryl chloride)

using model chemistry: MP2/6-31G*

States and conformations

All results from a given calculation for Cl₃PO (Phosphoryl chloride)