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	hartrees
Energy at 0K	-897.248576
Energy at 298.15K	-897.252446
HF Energy	-896.516385
Nuclear repulsion energy	387.029382

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1257	1161	314.76
2	A₁	881	814	257.20
3	A₁	790	730	103.37
4	A₁	618	571	9.07
5	A₁	414	382	67.82
6	A₂	390	360	0.00
7	B₁	1431	1322	319.59
8	B₁	593	548	63.61
9	B₁	116	107	46.45
10	B₂	877	810	451.07
11	B₂	675	624	1.06
12	B₂	486	449	0.84

Atom	x (Å)	y (Å)	z (Å)
Mg1	0.000	0.000	-1.898
S2	0.000	0.000	0.582
O3	0.000	1.194	-0.468
O4	0.000	-1.194	-0.468
O5	-1.241	0.000	1.310
O6	1.241	0.000	1.310

	Mg1	S2	O3	O4	O5	O6
Mg1		2.4799	1.8631	1.8631	3.4393	3.4393
S2	2.4799		1.5896	1.5896	1.4384	1.4384
O3	1.8631	1.5896		2.3876	2.4745	2.4745
O4	1.8631	1.5896	2.3876		2.4745	2.4745
O5	3.4393	1.4384	2.4745	2.4745		2.4814
O6	3.4393	1.4384	2.4745	2.4745	2.4814

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Mg1	O3	S2	91.472	Mg1	O4	S2	91.472
O3	Mg1	O4	79.697	O3	S2	O4	97.359
O3	S2	O5	109.516	O3	S2	O6	109.516
O4	S2	O5	109.516	O4	S2	O6	109.516
O5	S2	O6	119.210

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

using model chemistry: CID/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: CID/6-31G*

States and conformations

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