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	hartrees
Energy at 0K	-469.697162
Energy at 298.15K	-469.701197
HF Energy	-469.697162
Nuclear repulsion energy	159.365785

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3820	3776	0.00
2	A'	676	668	0.00
3	A'	625	618	0.00
4	A"	305	301	424.24
5	A"	274	271	2.27
6	E'	3819	3775	101.10
6	E'	3819	3775	101.08
7	E'	896	886	175.11
7	E'	896	886	175.11
8	E'	652	645	206.63
8	E'	652	645	206.61
9	E'	207	204	32.55
9	E'	207	204	32.54
10	E"	353	349	0.00
10	E"	353	349	0.00

Atom	x (Å)	y (Å)
Al1	0.000	0.000
O2	0.000	1.723
O3	-1.492	-0.862
O4	1.492	-0.862
H5	-0.835	2.217
H6	-1.503	-1.832
H7	2.338	-0.386

	Al1	O2	O3	O4	H5	H6	H7
Al1		1.7232	1.7232	1.7232	2.3693	2.3693	2.3693
O2	1.7232		2.9847	2.9847	0.9700	3.8595	3.1484
O3	1.7232	2.9847		2.9847	3.1484	0.9700	3.8595
O4	1.7232	2.9847	2.9847		3.8595	3.1484	0.9700
H5	2.3693	0.9700	3.1484	3.8595		4.1037	4.1037
H6	2.3693	3.8595	0.9700	3.1484	4.1037		4.1037
H7	2.3693	3.1484	3.8595	0.9700	4.1037	4.1037

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	O2	H5	120.623	Al1	O3	H6	120.623
Al1	O4	H7	120.623	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: PBEPBE/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	Al	0.434
2	O	-0.497
3	O	-0.497
4	O	-0.497
5	H	0.352
6	H	0.352
7	H	0.352

<r²>	105.903
(<r²>)^1/2	10.291

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

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

States and conformations

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