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	hartrees
Energy at 0K	-228.354866
Energy at 298.15K	-228.359823
HF Energy	-227.809754
Nuclear repulsion energy	121.651574

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3870	3575	77.68
2	A'	3300	3049	4.75
3	A'	3182	2939	1.37
4	A'	1969	1819	335.01
5	A'	1563	1444	13.26
6	A'	1516	1401	86.81
7	A'	1436	1326	33.53
8	A'	1302	1203	227.63
9	A'	1070	989	51.13
10	A'	920	849	1.72
11	A'	613	566	52.20
12	A'	439	405	4.51
13	A"	3257	3009	4.06
14	A"	1565	1445	8.98
15	A"	1136	1050	10.76
16	A"	706	652	129.42
17	A"	571	527	27.10
18	A"	98	90	0.35

Atom	x (Å)	y (Å)	z (Å)
C1	1.050	-0.915	0.000
C2	0.000	0.154	0.000
O3	0.197	1.339	0.000
H4	2.032	-0.455	0.000
H5	0.930	-1.546	0.879
H6	0.930	-1.546	-0.879
O7	-1.239	-0.371	0.000
H8	-1.856	0.373	0.000

	C1	C2	O3	H4	H5	H6	O7	H8
C1		1.4987	2.4100	1.0842	1.0883	1.0883	2.3529	3.1792
C2	1.4987		1.2010	2.1214	2.1278	2.1278	1.3460	1.8693
O3	2.4100	1.2010		2.5663	3.1034	3.1034	2.2334	2.2694
H4	1.0842	2.1214	2.5663		1.7820	1.7820	3.2723	3.9757
H5	1.0883	2.1278	3.1034	1.7820		1.7574	2.6187	3.4956
H6	1.0883	2.1278	3.1034	1.7820	1.7574		2.6187	3.4956
O7	2.3529	1.3460	2.2334	3.2723	2.6187	2.6187		0.9670
H8	3.1792	1.8693	2.2694	3.9757	3.4956	3.4956	0.9670

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	126.072	C1	C2	O7	111.499
C2	C1	H4	109.391	C2	C1	H5	109.651
C2	C1	H6	109.651	C2	O7	H8	106.682
O3	C2	O7	122.429	H4	C1	H5	110.218
H4	C1	H6	110.218	H5	C1	H6	107.689

All results from a given calculation for CH₃COOH (Acetic acid)

using model chemistry: CID/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 CH3COOH (Acetic acid)

using model chemistry: CID/6-31G*

States and conformations

All results from a given calculation for CH₃COOH (Acetic acid)