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	hartrees
Energy at 0K	-896.527747
Energy at 298.15K	-896.531775
HF Energy	-896.527747
Nuclear repulsion energy	390.477985

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1279	1156	359.17
2	A₁	930	841	241.11
3	A₁	819	740	128.86
4	A₁	639	578	9.96
5	A₁	429	388	77.94
6	A₂	419	379	0.00
7	B₁	1437	1300	403.27
8	B₁	626	566	74.46
9	B₁	119	107	46.81
10	B₂	928	839	507.81
11	B₂	704	636	9.92
12	B₂	501	453	0.01

Atom	x (Å)	y (Å)	z (Å)
Mg1	0.000	0.000	-1.899
S2	0.000	0.000	0.577
O3	0.000	1.172	-0.460
O4	0.000	-1.172	-0.460
O5	-1.226	0.000	1.307
O6	1.226	0.000	1.307

	Mg1	S2	O3	O4	O5	O6
Mg1		2.4767	1.8559	1.8559	3.4325	3.4325
S2	2.4767		1.5650	1.5650	1.4265	1.4265
O3	1.8559	1.5650		2.3434	2.4490	2.4490
O4	1.8559	1.5650	2.3434		2.4490	2.4490
O5	3.4325	1.4265	2.4490	2.4490		2.4519
O6	3.4325	1.4265	2.4490	2.4490	2.4519

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Mg1	O3	S2	92.372	Mg1	O4	S2	92.372
O3	Mg1	O4	78.298	O3	S2	O4	96.957
O3	S2	O5	109.813	O3	S2	O6	109.813
O4	S2	O5	109.813	O4	S2	O6	109.813
O5	S2	O6	118.498

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

using model chemistry: HF/6-31+G**

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	1.119
2	S	2.417
3	O	-0.959
4	O	-0.959
5	O	-0.809
6	O	-0.809

	x	y	z	Total
	0.000	0.000	-14.526	14.526
CHELPG
AIM
ESP

<r²>	148.916
(<r²>)^1/2	12.203

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

using model chemistry: HF/6-31+G**

States and conformations

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