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	hartrees
Energy at 0K	-623.189977
Energy at 298.15K
HF Energy	-622.138194
Nuclear repulsion energy	180.614514

Atom	x (Å)	y (Å)
S1	0.000	0.000
O2	0.000	1.450
O3	1.255	-0.725
O4	-1.255	-0.725

	S1	O2	O3	O4
S1		1.4497	1.4497	1.4497
O2	1.4497		2.5110	2.5110
O3	1.4497	2.5110		2.5110
O4	1.4497	2.5110	2.5110

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: MP4=FULL/aug-cc-pVTZ

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: MP4=FULL/aug-cc-pVTZ

States and conformations

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