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	hartrees
Energy at 0K	-228.429643
Energy at 298.15K	-228.434553
HF Energy	-227.808623
Nuclear repulsion energy	121.073592

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3771	3539	61.18
2	A'	3246	3047	4.00
3	A'	3128	2936	1.12
4	A'	1934	1816	297.41
5	A'	1535	1441	13.03
6	A'	1481	1390	84.66
7	A'	1409	1322	22.18
8	A'	1276	1198	227.04
9	A'	1045	981	50.98
10	A'	902	846	2.17
11	A'	600	563	49.55
12	A'	430	404	4.70
13	A"	3203	3006	3.36
14	A"	1533	1439	9.55
15	A"	1109	1041	8.96
16	A"	689	647	124.22
17	A"	558	524	24.92
18	A"	99	93	0.41

Atom	x (Å)	y (Å)	z (Å)
C1	1.063	-0.908	0.000
C2	0.000	0.154	0.000
O3	0.185	1.347	0.000
H4	2.044	-0.435	0.000
H5	0.948	-1.543	0.883
H6	0.948	-1.543	-0.883
O7	-1.242	-0.387	0.000
H8	-1.864	0.363	0.000

	C1	C2	O3	H4	H5	H6	O7	H8
C1		1.5030	2.4202	1.0890	1.0932	1.0932	2.3632	3.1910
C2	1.5030		1.2071	2.1271	2.1352	2.1352	1.3547	1.8756
O3	2.4202	1.2071		2.5751	3.1167	3.1167	2.2457	2.2734
H4	1.0890	2.1271	2.5751		1.7906	1.7906	3.2861	3.9884
H5	1.0932	2.1352	3.1167	1.7906		1.7653	2.6293	3.5100
H6	1.0932	2.1352	3.1167	1.7906	1.7653		2.6293	3.5100
O7	2.3632	1.3547	2.2457	3.2861	2.6293	2.6293		0.9740
H8	3.1910	1.8756	2.2734	3.9884	3.5100	3.5100	0.9740

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	126.165	C1	C2	O7	111.471
C2	C1	H4	109.258	C2	C1	H5	109.651
C2	C1	H6	109.651	C2	O7	H8	106.154
O3	C2	O7	122.363	H4	C1	H5	110.284
H4	C1	H6	110.284	H5	C1	H6	107.694

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

using model chemistry: MP3/6-31G*

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: MP3/6-31G*

States and conformations

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