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	hartrees
Energy at 0K	-470.053061
Energy at 298.15K	-470.057188
HF Energy	-470.053061
Nuclear repulsion energy	161.028766

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3851	3851	0.00
2	A'	696	696	0.00
3	A'	636	636	0.00
4	A"	306	306	334.51
5	A"	277	277	6.00
6	E'	3850	3850	84.09
6	E'	3850	3850	84.08
7	E'	914	914	144.54
7	E'	914	914	144.53
8	E'	658	658	200.87
8	E'	658	658	200.84
9	E'	221	221	26.34
9	E'	221	221	26.35
10	E"	349	349	0.00
10	E"	349	349	0.00

Atom	x (Å)	y (Å)
Al1	0.000	0.000
O2	0.000	1.705
O3	-1.477	-0.852
O4	1.477	-0.852
H5	-0.821	2.202
H6	-1.497	-1.812
H7	2.318	-0.390

	Al1	O2	O3	O4	H5	H6	H7
Al1		1.7049	1.7049	1.7049	2.3505	2.3505	2.3505
O2	1.7049		2.9530	2.9530	0.9602	3.8226	3.1243
O3	1.7049	2.9530		2.9530	3.1243	0.9602	3.8226
O4	1.7049	2.9530	2.9530		3.8226	3.1243	0.9602
H5	2.3505	0.9602	3.1243	3.8226		4.0712	4.0712
H6	2.3505	3.8226	0.9602	3.1243	4.0712		4.0712
H7	2.3505	3.1243	3.8226	0.9602	4.0712	4.0712

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	O2	H5	121.203	Al1	O3	H6	121.203
Al1	O4	H7	121.203	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: B97D3/cc-pV(T+d)Z

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	0.669
2	O	-0.422
3	O	-0.422
4	O	-0.422
5	H	0.199
6	H	0.199
7	H	0.199

	x	y	z
x	5.294	0.001	0.000
y	0.001	5.296	0.000
z	0.000	0.000	4.323

<r²>	103.499
(<r²>)^1/2	10.173

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

using model chemistry: B97D3/cc-pV(T+d)Z

States and conformations

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