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	hartrees
Energy at 0K	-470.063038
Energy at 298.15K	-470.067195
HF Energy	-470.063038
Nuclear repulsion energy	162.034546

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3974	3804	0.00
2	A'	705	675	0.00
3	A'	627	600	0.00
4	A"	322	308	388.19
5	A"	287	275	1.44
6	E'	3972	3803	120.47
6	E'	3972	3803	120.47
7	E'	933	893	174.93
7	E'	933	893	174.92
8	E'	638	611	216.78
8	E'	638	611	216.79
9	E'	222	213	29.76
9	E'	222	213	29.76
10	E"	355	340	0.00
10	E"	355	340	0.00

Atom	x (Å)	y (Å)
Al1	0.000	0.000
O2	0.000	1.693
O3	-1.466	-0.846
O4	1.466	-0.846
H5	-0.796	2.219
H6	-1.523	-1.799
H7	2.320	-0.420

	Al1	O2	O3	O4	H5	H6	H7
Al1		1.6926	1.6926	1.6926	2.3572	2.3572	2.3572
O2	1.6926		2.9316	2.9316	0.9545	3.8094	3.1371
O3	1.6926	2.9316		2.9316	3.1371	0.9545	3.8094
O4	1.6926	2.9316	2.9316		3.8094	3.1371	0.9545
H5	2.3572	0.9545	3.1371	3.8094		4.0829	4.0829
H6	2.3572	3.8094	0.9545	3.1371	4.0829		4.0829
H7	2.3572	3.1371	3.8094	0.9545	4.0829	4.0829

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	O2	H5	123.442	Al1	O3	H6	123.442
Al1	O4	H7	123.442	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: B3PW91/6-311+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	1.253
2	O	-0.643
3	O	-0.643
4	O	-0.643
5	H	0.225
6	H	0.225
7	H	0.225

<r²>	102.699
(<r²>)^1/2	10.134

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

using model chemistry: B3PW91/6-311+G(3df,2p)

States and conformations

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