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	hartrees
Energy at 0K	-66.910243
Energy at 298.15K	-66.912088
HF Energy	-66.180393
Nuclear repulsion energy	84.508666

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1273	1213	142.77
2	A₁	477	454	21.66
3	A₁	262	250	2.65
4	E	589	561	253.52
4	E	589	561	253.52
5	E	319	304	11.11
5	E	319	304	11.11
6	E	181	173	0.00
6	E	181	173	0.00

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.291
O2	0.000	0.000	1.783
Cl3	0.000	1.844	-0.579
Cl4	1.597	-0.922	-0.579
Cl5	-1.597	-0.922	-0.579

	P1	O2	Cl3	Cl4	Cl5
P1		1.4924	2.0384	2.0384	2.0384
O2	1.4924		2.9965	2.9965	2.9965
Cl3	2.0384	2.9965		3.1931	3.1931
Cl4	2.0384	2.9965	3.1931		3.1931
Cl5	2.0384	2.9965	3.1931	3.1931

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	P1	Cl3	115.259	O2	P1	Cl4	115.259
O2	P1	Cl5	115.259	Cl3	P1	Cl4	103.113
Cl3	P1	Cl5	103.113	Cl4	P1	Cl5	103.113

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

using model chemistry: MP2/CEP-121G*

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/CEP-121G*

States and conformations

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