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	hartrees
Energy at 0K	-303.900958
Energy at 298.15K	-303.895318
HF Energy	-302.651459
Nuclear repulsion energy	181.849893

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	4072	4072	84.49
2	A'	4057	4057	111.03
3	A'	3211	3211	28.38
4	A'	2026	2026	418.62
5	A'	1639	1639	7.06
6	A'	1626	1626	1.69
7	A'	1476	1476	149.00
8	A'	1407	1407	83.23
9	A'	1325	1325	179.46
10	A'	1243	1243	224.20
11	A'	935	935	41.50
12	A'	712	712	31.70
13	A'	511	511	26.79
14	A'	304	304	7.65
15	A"	3248	3248	30.23
16	A"	1372	1372	0.04
17	A"	1146	1146	3.72
18	A"	724	724	201.25
19	A"	555	555	10.81
20	A"	249	249	94.65
21	A"	37i	37i	46.02

Atom	x (Å)	y (Å)	z (Å)
C1	-0.588	-0.864	0.000
C2	0.000	0.521	0.000
O3	-0.917	1.470	0.000
O4	1.162	0.750	0.000
O5	0.405	-1.834	0.000
H6	-1.220	-0.965	0.878
H7	-1.220	-0.965	-0.878
H8	1.251	-1.410	0.000
H9	-0.482	2.313	0.000

	C1	C2	O3	O4	O5	H6	H7	H8	H9
C1		1.5049	2.3575	2.3804	1.3879	1.0868	1.0868	1.9186	3.1789
C2	1.5049		1.3197	1.1839	2.3896	2.1139	2.1139	2.3013	1.8556
O3	2.3575	1.3197		2.1997	3.5587	2.6061	2.6061	3.6053	0.9482
O4	2.3804	1.1839	2.1997		2.6923	3.0636	3.0636	2.1621	2.2682
O5	1.3879	2.3896	3.5587	2.6923		2.0419	2.0419	0.9463	4.2407
H6	1.0868	2.1139	2.6061	3.0636	2.0419		1.7559	2.6608	3.4726
H7	1.0868	2.1139	2.6061	3.0636	2.0419	1.7559		2.6608	3.4726
H8	1.9186	2.3013	3.6053	2.1621	0.9463	2.6608	2.6608		4.1070
H9	3.1789	1.8556	0.9482	2.2682	4.2407	3.4726	3.4726	4.1070

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	112.992	C1	C2	O4	124.143
C1	O5	H8	109.091	C2	C1	O5	111.319
C2	C1	H6	108.212	C2	C1	H7	108.212
C2	O3	H9	108.706	O3	C2	O4	122.865
O5	C1	H6	110.604	O5	C1	H7	110.604
H6	C1	H7	107.770

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

using model chemistry: CBS-Q

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: CBS-Q

States and conformations

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