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	hartrees
Energy at 0K	-898.050503
Energy at 298.15K	-898.054204
HF Energy	-896.733527
Nuclear repulsion energy	386.678266

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1200	1142	260.30
2	A₁	812	772	303.90
3	A₁	745	709	43.89
4	A₁	582	554	10.91
5	A₁	393	374	57.51
6	A₂	376	358	0.00
7	B₁	1368	1301	267.95
8	B₁	549	522	37.02
9	B₁	101	96	42.60
10	B₂	791	753	410.63
11	B₂	642	610	2.99
12	B₂	468	445	0.06

Atom	x (Å)	y (Å)	z (Å)
Mg1	0.000	0.000	-1.881
S2	0.000	0.000	0.574
O3	0.000	1.209	-0.470
O4	0.000	-1.209	-0.470
O5	-1.243	0.000	1.306
O6	1.243	0.000	1.306

	Mg1	S2	O3	O4	O5	O6
Mg1		2.4549	1.8578	1.8578	3.4208	3.4208
S2	2.4549		1.5974	1.5974	1.4428	1.4428
O3	1.8578	1.5974		2.4178	2.4824	2.4824
O4	1.8578	1.5974	2.4178		2.4824	2.4824
O5	3.4208	1.4428	2.4824	2.4824		2.4865
O6	3.4208	1.4428	2.4824	2.4824	2.4865

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Mg1	O3	S2	90.224	Mg1	O4	S2	90.224
O3	Mg1	O4	81.192	O3	S2	O4	98.361
O3	S2	O5	109.370	O3	S2	O6	109.370
O4	S2	O5	109.370	O4	S2	O6	109.370
O5	S2	O6	119.020

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

using model chemistry: MP2=FULL/aug-cc-pVTZ

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: MP2=FULL/aug-cc-pVTZ

States and conformations

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