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	hartrees
Energy at 0K	-623.050054
Energy at 298.15K	-623.052152
HF Energy	-622.171685
Nuclear repulsion energy	184.582648

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	1113	1113	0.00
2	A₂"	520	520	39.04
3	E'	1445	1445	201.22
3	E'	1445	1445	201.20
4	E'	542	542	31.43
4	E'	542	542	31.42

Atom	x (Å)	y (Å)
S1	0.000	0.000
O2	0.000	1.419
O3	1.229	-0.709
O4	-1.229	-0.709

	S1	O2	O3	O4
S1		1.4187	1.4187	1.4187
O2	1.4187		2.4572	2.4572
O3	1.4187	2.4572		2.4572
O4	1.4187	2.4572	2.4572

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O2	S1	O3	120.000		O2	S1	O4	120.000
O3	S1	O4	120.000

All results from a given calculation for SO₃ (Sulfur trioxide)

using model chemistry: QCISD/Def2TZVPP

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 SO3 (Sulfur trioxide)

using model chemistry: QCISD/Def2TZVPP

States and conformations

All results from a given calculation for SO₃ (Sulfur trioxide)