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	hartrees
Energy at 0K	-228.789702
Energy at 298.15K	-228.794565
HF Energy	-227.905991
Nuclear repulsion energy	121.588934

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3774	3590	76.57
2	A'	3221	3065	1.90
3	A'	3109	2957	0.89
4	A'	1825	1736	293.25
5	A'	1500	1427	15.23
6	A'	1430	1361	65.13
7	A'	1350	1285	42.84
8	A'	1214	1155	200.77
9	A'	1014	964	70.00
10	A'	884	841	5.14
11	A'	588	560	38.47
12	A'	428	407	3.58
13	A"	3182	3027	1.17
14	A"	1512	1438	8.82
15	A"	1083	1031	5.52
16	A"	669	636	85.29
17	A"	555	529	29.41
18	A"	80	76	0.25

Atom	x (Å)	y (Å)	z (Å)
C1	0.989	-0.973	0.000
C2	0.000	0.141	0.000
O3	0.291	1.319	0.000
H4	1.973	-0.527	0.000
H5	0.857	-1.598	0.879
H6	0.857	-1.598	-0.879
O7	-1.270	-0.294	0.000
H8	-1.796	0.515	0.000

	C1	C2	O3	H4	H5	H6	O7	H8
C1		1.4898	2.3951	1.0796	1.0867	1.0867	2.3587	3.1576
C2	1.4898		1.2127	2.0829	2.1287	2.1287	1.3424	1.8344
O3	2.3951	1.2127		2.4968	3.0980	3.0980	2.2446	2.2366
H4	1.0796	2.0829	2.4968		1.7786	1.7786	3.2508	3.9101
H5	1.0867	2.1287	3.0980	1.7786		1.7580	2.6448	3.5035
H6	1.0867	2.1287	3.0980	1.7786	1.7580		2.6448	3.5035
O7	2.3587	1.3424	2.2446	3.2508	2.6448	2.6448		0.9653
H8	3.1576	1.8344	2.2366	3.9101	3.5035	3.5035	0.9653

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	124.489	C1	C2	O7	112.674
C2	C1	H4	107.247	C2	C1	H5	110.445
C2	C1	H6	110.445	C2	O7	H8	104.095
O3	C2	O7	122.838	H4	C1	H5	110.377
H4	C1	H6	110.377	H5	C1	H6	107.965

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

using model chemistry: MP2=FULL/aug-cc-pVTZ

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: MP2=FULL/aug-cc-pVTZ

States and conformations

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