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	hartrees
Energy at 0K	-470.220525
Energy at 298.15K	-470.224702
HF Energy	-470.220525
Nuclear repulsion energy	161.414004

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3916	3916	0.00
2	A'	705	705	0.00
3	A'	637	637	0.00
4	A"	327	327	369.66
5	A"	288	288	15.03
6	E'	3915	3915	116.00
6	E'	3915	3915	116.06
7	E'	927	927	173.86
7	E'	927	927	174.00
8	E'	652	652	213.18
8	E'	652	652	213.28
9	E'	225	225	29.62
9	E'	225	225	29.63
10	E"	358	358	0.00
10	E"	358	358	0.00

Atom	x (Å)	y (Å)
Al1	0.000	0.000
O2	0.000	1.699
O3	-1.472	-0.850
O4	1.472	-0.850
H5	-0.797	2.229
H6	-1.532	-1.805
H7	2.329	-0.424

	Al1	O2	O3	O4	H5	H6	H7
Al1		1.6992	1.6992	1.6992	2.3670	2.3670	2.3670
O2	1.6992		2.9432	2.9432	0.9568	3.8240	3.1515
O3	1.6992	2.9432		2.9432	3.1515	0.9568	3.8240
O4	1.6992	2.9432	2.9432		3.8240	3.1515	0.9568
H5	2.3670	0.9568	3.1515	3.8240		4.0998	4.0998
H6	2.3670	3.8240	0.9568	3.1515	4.0998		4.0998
H7	2.3670	3.1515	3.8240	0.9568	4.0998	4.0998

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	O2	H5	123.607	Al1	O3	H6	123.607
Al1	O4	H7	123.607	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/daug-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	1.260
2	O	-0.781
3	O	-0.781
4	O	-0.781
5	H	0.361
6	H	0.361
7	H	0.361

	x	y	z
x	5.700	0.001	0.000
y	0.001	5.701	0.000
z	0.000	0.000	4.787

<r²>	103.656
(<r²>)^1/2	10.181

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

using model chemistry: B3LYP/daug-cc-pVTZ

States and conformations

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