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	hartrees
Energy at 0K	-896.848180
Energy at 298.15K	-896.850854
HF Energy	-896.213299
Nuclear repulsion energy	351.845683

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	980	946	187.18
2	A₁	643	620	147.42
3	A₁	573	553	179.44
4	A₁	435	420	75.82
5	A₁	317	306	39.84
6	A₂	256	247	0.00
7	B₁	1086	1049	238.32
8	B₁	412	398	61.23
9	B₁	110	107	45.32
10	B₂	611	590	179.16
11	B₂	439	424	152.68
12	B₂	339	327	4.90

Atom	x (Å)	y (Å)	z (Å)
Mg1	0.000	0.000	-2.026
S2	0.000	0.000	0.666
O3	0.000	1.304	-0.599
O4	0.000	-1.304	-0.599
O5	-1.367	0.000	1.453
O6	1.367	0.000	1.453

	Mg1	S2	O3	O4	O5	O6
Mg1		2.6921	1.9331	1.9331	3.7379	3.7379
S2	2.6921		1.8170	1.8170	1.5775	1.5775
O3	1.9331	1.8170		2.6084	2.7894	2.7894
O4	1.9331	1.8170	2.6084		2.7894	2.7894
O5	3.7379	1.5775	2.7894	2.7894		2.7347
O6	3.7379	1.5775	2.7894	2.7894	2.7347

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Mg1	O3	S2	91.702	Mg1	O4	S2	91.702
O3	Mg1	O4	84.854	O3	S2	O4	91.742
O3	S2	O5	110.320	O3	S2	O6	110.320
O4	S2	O5	110.320	O4	S2	O6	110.320
O5	S2	O6	120.167

All results from a given calculation for MgSO₄ (Magnesium Sulfate)

using model chemistry: MP2/SDD

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 MgSO4 (Magnesium Sulfate)

using model chemistry: MP2/SDD

States and conformations

All results from a given calculation for MgSO₄ (Magnesium Sulfate)