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	hartrees
Energy at 0K	-470.043778
Energy at 298.15K	-470.047830
HF Energy	-470.043778
Nuclear repulsion energy	159.038560

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3778	3758	0.00
2	A'	675	671	0.00
3	A'	622	619	0.00
4	A"	310	308	424.10
5	A"	277	275	8.09
6	E'	3777	3757	92.44
6	E'	3777	3757	92.40
7	E'	891	886	178.26
7	E'	891	886	178.23
8	E'	648	645	209.29
8	E'	648	645	209.28
9	E'	211	210	32.43
9	E'	211	210	32.43
10	E"	355	353	0.00
10	E"	355	353	0.00

Atom	x (Å)	y (Å)
Al1	0.000	0.000
O2	0.000	1.726
O3	-1.495	-0.863
O4	1.495	-0.863
H5	-0.829	2.234
H6	-1.520	-1.835
H7	2.349	-0.399

	Al1	O2	O3	O4	H5	H6	H7
Al1		1.7261	1.7261	1.7261	2.3828	2.3828	2.3828
O2	1.7261		2.9896	2.9896	0.9720	3.8718	3.1679
O3	1.7261	2.9896		2.9896	3.1679	0.9720	3.8718
O4	1.7261	2.9896	2.9896		3.8718	3.1679	0.9720
H5	2.3828	0.9720	3.1679	3.8718		4.1271	4.1271
H6	2.3828	3.8718	0.9720	3.1679	4.1271		4.1271
H7	2.3828	3.1679	3.8718	0.9720	4.1271	4.1271

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	O2	H5	121.504	Al1	O3	H6	121.504
Al1	O4	H7	121.504	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: BLYP/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	0.469
2	O	-0.503
3	O	-0.503
4	O	-0.503
5	H	0.346
6	H	0.346
7	H	0.346

	x	y	z
x	5.611	0.001	0.000
y	0.001	5.611	0.000
z	0.000	0.000	4.391

<r²>	106.468
(<r²>)^1/2	10.318

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

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

States and conformations

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