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	hartrees
Energy at 0K	-896.517711
Energy at 298.15K	-896.521744
HF Energy	-896.517711
Nuclear repulsion energy	390.600951

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1291	1165	350.11
2	A₁	931	840	239.51
3	A₁	819	739	124.17
4	A₁	643	580	9.73
5	A₁	431	389	75.74
6	A₂	416	376	0.00
7	B₁	1461	1318	369.98
8	B₁	629	568	76.36
9	B₁	121	109	47.85
10	B₂	932	841	494.68
11	B₂	703	635	7.15
12	B₂	502	453	0.26

Atom	x (Å)	y (Å)	z (Å)
Mg1	0.000	0.000	-1.895
S2	0.000	0.000	0.578
O3	0.000	1.174	-0.461
O4	0.000	-1.174	-0.461
O5	-1.227	0.000	1.304
O6	1.227	0.000	1.304

	Mg1	S2	O3	O4	O5	O6
Mg1		2.4730	1.8531	1.8531	3.4255	3.4255
S2	2.4730		1.5675	1.5675	1.4253	1.4253
O3	1.8531	1.5675		2.3474	2.4486	2.4486
O4	1.8531	1.5675	2.3474		2.4486	2.4486
O5	3.4255	1.4253	2.4486	2.4486		2.4539
O6	3.4255	1.4253	2.4486	2.4486	2.4539

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Mg1	O3	S2	92.217	Mg1	O4	S2	92.217
O3	Mg1	O4	78.598	O3	S2	O4	96.967
O3	S2	O5	109.712	O3	S2	O6	109.712
O4	S2	O5	109.712	O4	S2	O6	109.712
O5	S2	O6	118.822

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

using model chemistry: HF/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	1.251
2	S	1.856
3	O	-0.893
4	O	-0.893
5	O	-0.660
6	O	-0.660

	x	y	z	Total
	0.000	0.000	-14.252	14.252
CHELPG
AIM
ESP

<r²>	148.352
(<r²>)^1/2	12.180

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

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

States and conformations

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