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	hartrees
Energy at 0K	-469.879497
Energy at 298.15K	-469.883644
HF Energy	-469.879497
Nuclear repulsion energy	162.478257

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3984	3984	0.00
2	A'	711	711	0.00
3	A'	628	628	0.00
4	A"	320	320	396.97
5	A"	283	283	0.13
6	E'	3982	3982	124.52
6	E'	3982	3982	124.52
7	E'	944	944	167.97
7	E'	944	944	167.95
8	E'	640	640	220.35
8	E'	640	640	220.36
9	E'	225	225	30.10
9	E'	225	225	30.11
10	E"	351	351	0.00
10	E"	351	351	0.00

Atom	x (Å)	y (Å)
Al1	0.000	0.000
O2	0.000	1.688
O3	-1.462	-0.844
O4	1.462	-0.844
H5	-0.796	2.212
H6	-1.517	-1.796
H7	2.314	-0.416

	Al1	O2	O3	O4	H5	H6	H7
Al1		1.6877	1.6877	1.6877	2.3507	2.3507	2.3507
O2	1.6877		2.9232	2.9232	0.9533	3.7994	3.1272
O3	1.6877	2.9232		2.9232	3.1272	0.9533	3.7994
O4	1.6877	2.9232	2.9232		3.7994	3.1272	0.9533
H5	2.3507	0.9533	3.1272	3.7994		4.0716	4.0716
H6	2.3507	3.7994	0.9533	3.1272	4.0716		4.0716
H7	2.3507	3.1272	3.7994	0.9533	4.0716	4.0716

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	O2	H5	123.346	Al1	O3	H6	123.346
Al1	O4	H7	123.346	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/Def2TZVPP

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	0.737
2	O	-0.433
3	O	-0.433
4	O	-0.433
5	H	0.187
6	H	0.187
7	H	0.187

	x	y	z
x	5.019	-0.000	0.000
y	-0.000	5.020	0.000
z	0.000	0.000	4.070

<r²>	102.012
(<r²>)^1/2	10.100

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

using model chemistry: HSEh1PBE/Def2TZVPP

States and conformations

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