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	hartrees
Energy at 0K	-468.327895
Energy at 298.15K	-468.331959
HF Energy	-468.327895
Nuclear repulsion energy	162.147909

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3836	3805	0.00
2	A'	701	695	0.00
3	A'	612	608	0.00
4	A"	310	307	353.02
5	A"	278	276	7.15
6	E'	3834	3804	130.08
6	E'	3834	3804	130.06
7	E'	937	929	158.48
7	E'	937	929	158.46
8	E'	625	620	201.72
8	E'	625	620	201.71
9	E'	208	206	29.50
9	E'	208	206	29.49
10	E"	349	347	0.00
10	E"	349	347	0.00

Atom	x (Å)	y (Å)
Al1	0.000	0.000
O2	0.000	1.690
O3	-1.463	-0.845
O4	1.463	-0.845
H5	-0.815	2.209
H6	-1.506	-1.810
H7	2.320	-0.399

	Al1	O2	O3	O4	H5	H6	H7
Al1		1.6895	1.6895	1.6895	2.3542	2.3542	2.3542
O2	1.6895		2.9263	2.9263	0.9660	3.8095	3.1217
O3	1.6895	2.9263		2.9263	3.1217	0.9660	3.8095
O4	1.6895	2.9263	2.9263		3.8095	3.1217	0.9660
H5	2.3542	0.9660	3.1217	3.8095		4.0777	4.0777
H6	2.3542	3.8095	0.9660	3.1217	4.0777		4.0777
H7	2.3542	3.1217	3.8095	0.9660	4.0777	4.0777

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	O2	H5	122.520	Al1	O3	H6	122.520
Al1	O4	H7	122.520	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: SVWN/aug-cc-pVTZ

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	0.760
2	O	-0.359
3	O	-0.359
4	O	-0.359
5	H	0.106
6	H	0.106
7	H	0.106

<r²>	102.555
(<r²>)^1/2	10.127

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

using model chemistry: SVWN/aug-cc-pVTZ

States and conformations

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