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	hartrees
Energy at 0K	-897.389300
Energy at 298.15K	-897.393025
HF Energy	-896.512813
Nuclear repulsion energy	383.646916

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1216	1151	283.96
2	A₁	824	780	282.29
3	A₁	765	724	69.30
4	A₁	596	564	10.68
5	A₁	399	378	61.83
6	A₂	369	349	0.00
7	B₁	1392	1318	280.99
8	B₁	564	533	54.51
9	B₁	113	107	44.84
10	B₂	823	779	407.44
11	B₂	646	612	1.45
12	B₂	471	446	1.32

Atom	x (Å)	y (Å)	z (Å)
Mg1	0.000	0.000	-1.902
S2	0.000	0.000	0.586
O3	0.000	1.213	-0.476
O4	0.000	-1.213	-0.476
O5	-1.253	0.000	1.316
O6	1.253	0.000	1.316

	Mg1	S2	O3	O4	O5	O6
Mg1		2.4877	1.8719	1.8719	3.4529	3.4529
S2	2.4877		1.6125	1.6125	1.4499	1.4499
O3	1.8719	1.6125		2.4264	2.5006	2.5006
O4	1.8719	1.6125	2.4264		2.5006	2.5006
O5	3.4529	1.4499	2.5006	2.5006		2.5054
O6	3.4529	1.4499	2.5006	2.5006	2.5054

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Mg1	O3	S2	90.803	Mg1	O4	S2	90.803
O3	Mg1	O4	80.800	O3	S2	O4	97.595
O3	S2	O5	109.369	O3	S2	O6	109.369
O4	S2	O5	109.369	O4	S2	O6	109.369
O5	S2	O6	119.541

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

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

States and conformations

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