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	hartrees
Energy at 0K	-304.320615
Energy at 298.15K	-304.326265
HF Energy	-304.320615
Nuclear repulsion energy	179.989130

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3716	3586	52.04
2	A	3668	3539	73.50
3	A	3022	2916	26.16
4	A	2998	2893	33.14
5	A	1812	1749	243.66
6	A	1504	1451	6.51
7	A	1476	1425	20.34
8	A	1366	1318	138.38
9	A	1296	1251	19.83
10	A	1238	1195	0.43
11	A	1171	1130	123.63
12	A	1116	1077	208.59
13	A	1036	1000	0.68
14	A	855	825	35.73
15	A	664	641	114.66
16	A	642	620	16.65
17	A	504	486	2.89
18	A	465	448	27.88
19	A	362	350	65.09
20	A	283	273	8.49
21	A	93	89	6.52

Atom	x (Å)	y (Å)	z (Å)
C1	-0.740	-0.754	0.018
C2	0.514	0.100	0.006
O3	1.635	-0.639	-0.014
O4	0.485	1.309	0.010
O5	-1.878	0.055	-0.019
H6	-0.701	-1.441	-0.840
H7	-0.723	-1.373	0.927
H8	-1.547	0.965	-0.031
H9	2.385	-0.026	-0.016

	C1	C2	O3	O4	O5	H6	H7	H8	H9
C1		1.5178	2.3776	2.3991	1.3966	1.0995	1.1001	1.8996	3.2093
C2	1.5178		1.3424	1.2085	2.3926	2.1373	2.1333	2.2356	1.8753
O3	2.3776	1.3424		2.2615	3.5802	2.6033	2.6427	3.5630	0.9695
O4	2.3991	1.2085	2.2615		2.6750	3.1127	3.0813	2.0616	2.3217
O5	1.3966	2.3926	3.5802	2.6750		2.0735	2.0658	0.9680	4.2637
H6	1.0995	2.1373	2.6033	3.1127	2.0735		1.7678	2.6758	3.4934
H7	1.1001	2.1333	2.6427	3.0813	2.0658	1.7678		2.6576	3.5169
H8	1.8996	2.2356	3.5630	2.0616	0.9680	2.6758	2.6576		4.0551
H9	3.2093	1.8753	0.9695	2.3217	4.2637	3.4934	3.5169	4.0551

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	112.316	C1	C2	O4	122.880
C1	O5	H8	105.460	C2	C1	O5	110.294
C2	C1	H6	108.434	C2	C1	H7	108.096
C2	O3	H9	107.315	O3	C2	O4	124.803
O5	C1	H6	111.786	O5	C1	H7	111.110
H6	C1	H7	106.973

All results from a given calculation for HOCH₂COOH (Hydroxyacetic acid)

using model chemistry: TPSSh/6-31G(2df,p)

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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All results from a given calculation for HOCH2COOH (Hydroxyacetic acid)

using model chemistry: TPSSh/6-31G(2df,p)

States and conformations

All results from a given calculation for HOCH₂COOH (Hydroxyacetic acid)