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	hartrees
Energy at 0K	-895.935105
Energy at 298.15K	-895.938536
HF Energy	-895.935105
Nuclear repulsion energy	383.047433

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1168	1149	212.29
2	A₁	759	747	252.67
3	A₁	734	722	15.37
4	A₁	555	546	6.94
5	A₁	374	368	38.55
6	A₂	315	310	0.00
7	B₁	1347	1325	159.30
8	B₁	495	487	22.56
9	B₁	99	97	34.79
10	B₂	748	735	277.03
11	B₂	604	594	20.59
12	B₂	433	426	3.35

Atom	x (Å)	y (Å)	z (Å)
Mg1	0.000	0.000	-1.874
S2	0.000	0.000	0.581
O3	0.000	1.230	-0.486
O4	0.000	-1.230	-0.486
O5	-1.262	0.000	1.310
O6	1.262	0.000	1.310

	Mg1	S2	O3	O4	O5	O6
Mg1		2.4553	1.8546	1.8546	3.4249	3.4249
S2	2.4553		1.6278	1.6278	1.4574	1.4574
O3	1.8546	1.6278		2.4590	2.5156	2.5156
O4	1.8546	1.6278	2.4590		2.5156	2.5156
O5	3.4249	1.4574	2.5156	2.5156		2.5245
O6	3.4249	1.4574	2.5156	2.5156	2.5245

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Mg1	O3	S2	89.421	Mg1	O4	S2	89.421
O3	Mg1	O4	83.050	O3	S2	O4	98.108
O3	S2	O5	109.124	O3	S2	O6	109.124
O4	S2	O5	109.124	O4	S2	O6	109.124
O5	S2	O6	120.014

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

using model chemistry: SVWN/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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Number	Element	Mulliken
1	Mg	0.837
2	S	1.223
3	O	-0.603
4	O	-0.603
5	O	-0.427
6	O	-0.427

	x	y	z	Total
	0.000	0.000	-11.423	11.423
CHELPG
AIM
ESP

<r²>	152.146
(<r²>)^1/2	12.335

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

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

States and conformations

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