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	hartrees
Energy at 0K	-302.996174
Energy at 298.15K
HF Energy	-302.511135
Nuclear repulsion energy	177.406807

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3776	3541	72.64
2	A'	3773	3538	42.98
3	A'	3140	2945	12.63
4	A'	1814	1701	242.15
5	A'	1602	1503	12.90
6	A'	1522	1427	6.86
7	A'	1412	1324	113.37
8	A'	1356	1271	51.13
9	A'	1197	1122	182.98
10	A'	1097	1029	197.25
11	A'	896	840	37.66
12	A'	659	618	23.88
13	A'	481	451	32.10
14	A'	290	272	7.62
15	A"	3181	2983	15.19
16	A"	1282	1202	0.65
17	A"	1107	1038	1.44
18	A"	660	619	233.63
19	A"	534	501	15.48
20	A"	235	221	101.92
21	A"	73i	68i	70.63

Atom	x (Å)	y (Å)	z (Å)
C1	-0.608	-0.861	0.000
C2	0.000	0.522	0.000
O3	-0.950	1.504	0.000
O4	1.210	0.749	0.000
O5	0.414	-1.871	0.000
H6	-1.240	-0.971	0.885
H7	-1.240	-0.971	-0.885
H8	1.298	-1.470	0.000
H9	-0.562	2.395	0.000

	C1	C2	O3	O4	O5	H6	H7	H8	H9
C1		1.5104	2.3894	2.4278	1.4376	1.0927	1.0927	2.0013	3.2558
C2	1.5104		1.3666	1.2308	2.4289	2.1326	2.1326	2.3774	1.9552
O3	2.3894	1.3666		2.2882	3.6408	2.6442	2.6442	3.7282	0.9718
O4	2.4278	1.2308	2.2882		2.7381	3.1208	3.1208	2.2200	2.4182
O5	1.4376	2.4289	3.6408	2.7381		2.0808	2.0808	0.9711	4.3763
H6	1.0927	2.1326	2.6442	3.1208	2.0808		1.7696	2.7339	3.5454
H7	1.0927	2.1326	2.6442	3.1208	2.0808	1.7696		2.7339	3.5454
H8	2.0013	2.3774	3.7282	2.2200	0.9711	2.7339	2.7339		4.2887
H9	3.2558	1.9552	0.9718	2.4182	4.3763	3.5454	3.5454	4.2887

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	112.209	C1	C2	O4	124.352
C1	O5	H8	110.892	C2	C1	O5	110.933
C2	C1	H6	108.966	C2	C1	H7	108.966
C2	O3	H9	112.377	O3	C2	O4	123.438
O5	C1	H6	109.892	O5	C1	H7	109.892
H6	C1	H7	108.135

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

using model chemistry: CISD/6-31G

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: CISD/6-31G

States and conformations

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