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	hartrees
Energy at 0K	-467.558672
Energy at 298.15K	-467.562712
HF Energy	-467.558672
Nuclear repulsion energy	161.559857

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3653	3514	0.00
2	A'	750	721	0.00
3	A'	585	563	0.00
4	A"	306	295	421.46
5	A"	254	245	120.43
6	E'	3654	3515	38.43
6	E'	3654	3515	38.44
7	E'	1017	979	98.31
7	E'	1017	979	98.31
8	E'	596	573	290.26
8	E'	596	573	290.27
9	E'	253	243	30.07
9	E'	253	243	30.07
10	E"	314	302	0.00
10	E"	314	302	0.00

Atom	x (Å)	y (Å)
Al1	0.000	0.000
O2	0.000	1.691
O3	-1.464	-0.845
O4	1.464	-0.845
H5	-0.801	2.259
H6	-1.556	-1.823
H7	2.357	-0.435

	Al1	O2	O3	O4	H5	H6	H7
Al1		1.6909	1.6909	1.6909	2.3968	2.3968	2.3968
O2	1.6909		2.9288	2.9288	0.9822	3.8433	3.1744
O3	1.6909	2.9288		2.9288	3.1744	0.9822	3.8433
O4	1.6909	2.9288	2.9288		3.8433	3.1744	0.9822
H5	2.3968	0.9822	3.1744	3.8433		4.1515	4.1515
H6	2.3968	3.8433	0.9822	3.1744	4.1515		4.1515
H7	2.3968	3.1744	3.8433	0.9822	4.1515	4.1515

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	O2	H5	125.328	Al1	O3	H6	125.328
Al1	O4	H7	125.328	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: B3LYP/3-21G*

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	0.801
2	O	-0.635
3	O	-0.635
4	O	-0.635
5	H	0.368
6	H	0.368
7	H	0.368

	x	y	z
x	4.273	0.001	0.000
y	0.001	4.273	0.000
z	0.000	0.000	2.590

<r²>	102.099
(<r²>)^1/2	10.104

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

using model chemistry: B3LYP/3-21G*

States and conformations

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