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	hartrees
Energy at 0K	-469.863257
Energy at 298.15K	-469.867418
HF Energy	-469.863257
Nuclear repulsion energy	162.286103

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3995	3995	0.00
2	A'	709	709	0.00
3	A'	626	626	0.00
4	A"	323	323	393.55
5	A"	287	287	0.98
6	E'	3993	3993	126.69
6	E'	3993	3993	126.68
7	E'	940	940	177.25
7	E'	940	940	177.26
8	E'	637	637	217.87
8	E'	637	637	217.92
9	E'	221	221	30.23
9	E'	221	221	30.25
10	E"	356	356	0.00
10	E"	356	356	0.00

Atom	x (Å)	y (Å)
Al1	0.000	0.000
O2	0.000	1.690
O3	-1.463	-0.845
O4	1.463	-0.845
H5	-0.793	2.218
H6	-1.524	-1.796
H7	2.318	-0.422

	Al1	O2	O3	O4	H5	H6	H7
Al1		1.6897	1.6897	1.6897	2.3557	2.3557	2.3557
O2	1.6897		2.9267	2.9267	0.9532	3.8046	3.1353
O3	1.6897	2.9267		2.9267	3.1353	0.9532	3.8046
O4	1.6897	2.9267	2.9267		3.8046	3.1354	0.9532
H5	2.3557	0.9532	3.1353	3.8046		4.0802	4.0802
H6	2.3557	3.8046	0.9532	3.1354	4.0802		4.0802
H7	2.3557	3.1353	3.8046	0.9532	4.0802	4.0802

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	O2	H5	123.658	Al1	O3	H6	123.658
Al1	O4	H7	123.658	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: HSEh1PBE/6-311+G(3df,2p)

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	1.234
2	O	-0.636
3	O	-0.636
4	O	-0.636
5	H	0.225
6	H	0.225
7	H	0.225

	x	y	z
x	5.393	-0.000	0.000
y	-0.000	5.394	0.000
z	0.000	0.000	4.502

<r²>	102.467
(<r²>)^1/2	10.123

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

using model chemistry: HSEh1PBE/6-311+G(3df,2p)

States and conformations

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