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	hartrees
Energy at 0K	-470.050570
Energy at 298.15K	-470.054629
HF Energy	-470.050570
Nuclear repulsion energy	160.724884

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3886	3725	0.00
2	A'	702	673	0.00
3	A'	650	624	0.00
4	A"	296	284	373.03
5	A"	255	245	71.61
6	E'	3885	3725	79.64
6	E'	3885	3725	79.68
7	E'	942	903	136.61
7	E'	942	903	136.62
8	E'	682	654	233.16
8	E'	682	654	233.13
9	E'	225	215	29.68
9	E'	225	215	29.68
10	E"	325	312	0.00
10	E"	325	312	0.00

Atom	x (Å)	y (Å)
Al1	0.000	0.000
O2	0.000	1.709
O3	-1.480	-0.855
O4	1.480	-0.855
H5	-0.839	2.183
H6	-1.471	-1.819
H7	2.310	-0.365

	Al1	O2	O3	O4	H5	H6	H7
Al1		1.7091	1.7091	1.7091	2.3389	2.3389	2.3389
O2	1.7091		2.9603	2.9603	0.9640	3.8220	3.1045
O3	1.7091	2.9603		2.9603	3.1045	0.9640	3.8220
O4	1.7091	2.9603	2.9603		3.8220	3.1045	0.9640
H5	2.3389	0.9640	3.1045	3.8220		4.0511	4.0511
H6	2.3389	3.8220	0.9640	3.1045	4.0511		4.0511
H7	2.3389	3.1045	3.8220	0.9640	4.0511	4.0511

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	O2	H5	119.448	Al1	O3	H6	119.448
Al1	O4	H7	119.448	O2	Al1	O3	120.000
O2	Al1	O4	120.000	O3	Al1	O4	120.000

All results from a given calculation for H₃AlO₃ (Aluminum hydroxide)

using model chemistry: TPSSh/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	Al	1.011
2	O	-0.671
3	O	-0.671
4	O	-0.671
5	H	0.334
6	H	0.334
7	H	0.334

	x	y	z
x	4.606	-0.001	0.000
y	-0.001	4.606	0.000
z	0.000	0.000	3.232

<r²>	103.459
(<r²>)^1/2	10.171

All results from a given calculation for H3AlO3 (Aluminum hydroxide)

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

States and conformations

All results from a given calculation for H₃AlO₃ (Aluminum hydroxide)