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	hartrees
Energy at 0K	-896.785887
Energy at 298.15K	-896.788393
HF Energy	-896.146899
Nuclear repulsion energy	347.265626

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	837	807	110.30
2	A₁	647	624	94.82
3	A₁	566	545	100.99
4	A₁	419	404	18.91
5	A₁	289	278	34.70
6	A₂	233	225	0.00
7	B₁	933	899	46.80
8	B₁	375	361	49.69
9	B₁	102	98	40.34
10	B₂	602	580	88.15
11	B₂	519	500	62.14
12	B₂	303	292	2.19

Atom	x (Å)	y (Å)	z (Å)
Mg1	0.000	0.000	-2.013
S2	0.000	0.000	0.652
O3	0.000	1.315	-0.604
O4	0.000	-1.315	-0.604
O5	-1.430	0.000	1.462
O6	1.430	0.000	1.462

	Mg1	S2	O3	O4	O5	O6
Mg1		2.6645	1.9270	1.9270	3.7581	3.7581
S2	2.6645		1.8186	1.8186	1.6439	1.6439
O3	1.9270	1.8186		2.6303	2.8367	2.8367
O4	1.9270	1.8186	2.6303		2.8367	2.8367
O5	3.7581	1.6439	2.8367	2.8367		2.8600
O6	3.7581	1.6439	2.8367	2.8367	2.8600

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Mg1	O3	S2	90.645	Mg1	O4	S2	90.645
O3	Mg1	O4	86.076	O3	S2	O4	92.634
O3	S2	O5	109.918	O3	S2	O6	109.918
O4	S2	O5	109.918	O4	S2	O6	109.918
O5	S2	O6	120.890

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

using model chemistry: QCISD/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 MgSO4 (Magnesium Sulfate)

using model chemistry: QCISD/6-31G

States and conformations

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