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	hartrees
Energy at 0K	-470.170878
Energy at 298.15K	-470.174978
HF Energy	-470.170878
Nuclear repulsion energy	160.438671

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3768	3768	0.00
2	A'	694	694	0.00
3	A'	630	630	0.00
4	A"	298	298	314.35
5	A"	275	275	23.17
6	E'	3768	3768	81.84
6	E'	3768	3768	81.79
7	E'	906	906	135.91
7	E'	906	906	135.86
8	E'	657	657	196.97
8	E'	657	657	197.01
9	E'	218	218	25.50
9	E'	218	218	25.51
10	E"	344	344	0.00
10	E"	344	344	0.00

Atom	x (Å)	y (Å)
Al1	0.000	0.000
O2	0.000	1.710
O3	-1.481	-0.855
O4	1.481	-0.855
H5	-0.826	2.212
H6	-1.503	-1.822
H7	2.329	-0.391

	Al1	O2	O3	O4	H5	H6	H7
Al1		1.7105	1.7105	1.7105	2.3617	2.3617	2.3617
O2	1.7105		2.9626	2.9626	0.9668	3.8387	3.1368
O3	1.7105	2.9626		2.9626	3.1368	0.9668	3.8387
O4	1.7105	2.9626	2.9626		3.8387	3.1368	0.9668
H5	2.3617	0.9668	3.1368	3.8387		4.0906	4.0906
H6	2.3617	3.8387	0.9668	3.1368	4.0906		4.0906
H7	2.3617	3.1368	3.8387	0.9668	4.0906	4.0906

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	O2	H5	121.274	Al1	O3	H6	121.274
Al1	O4	H7	121.273	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/cc-pCVTZ

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	0.548
2	O	-0.386
3	O	-0.386
4	O	-0.386
5	H	0.203
6	H	0.203
7	H	0.203

	x	y	z
x	5.466	0.001	0.000
y	0.001	5.467	0.000
z	0.000	0.000	4.387

<r²>	104.284
(<r²>)^1/2	10.212

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

using model chemistry: BLYP/cc-pCVTZ

States and conformations

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