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	hartrees
Energy at 0K	-44.981543
Energy at 298.15K	-44.986262
HF Energy	-44.598462
Nuclear repulsion energy	65.354678

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3640	3517	38.26
2	A'	3202	3094	18.62
3	A'	3069	2966	8.73
4	A'	1667	1611	181.22
5	A'	1510	1459	24.39
6	A'	1457	1408	28.02
7	A'	1319	1274	60.98
8	A'	1174	1135	161.49
9	A'	1007	973	134.96
10	A'	817	790	32.86
11	A'	539	520	39.04
12	A'	399	386	5.30
13	A"	3173	3066	18.22
14	A"	1504	1453	13.93
15	A"	1105	1067	5.82
16	A"	629	608	187.72
17	A"	527	510	19.37
18	A"	83	80	0.77

Atom	x (Å)	y (Å)	z (Å)
C1	1.201	-0.800	0.000
C2	0.000	0.161	0.000
O3	0.022	1.428	0.000
H4	2.135	-0.211	0.000
H5	1.155	-1.449	0.897
H6	1.155	-1.449	-0.897
O7	-1.228	-0.567	0.000
H8	-2.001	0.057	0.000

	C1	C2	O3	H4	H5	H6	O7	H8
C1		1.5380	2.5210	1.1051	1.1079	1.1079	2.4402	3.3139
C2	1.5380		1.2677	2.1675	2.1748	2.1748	1.4280	2.0033
O3	2.5210	1.2677		2.6743	3.2196	3.2196	2.3552	2.4442
H4	1.1051	2.1675	2.6743		1.8162	1.8162	3.3826	4.1446
H5	1.1079	2.1748	3.2196	1.8162		1.7941	2.6949	3.6094
H6	1.1079	2.1748	3.2196	1.8162	1.7941		2.6949	3.6094
O7	2.4402	1.4280	2.3552	3.3826	2.6949	2.6949		0.9926
H8	3.3139	2.0033	2.4442	4.1446	3.6094	3.6094	0.9926

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	127.670	C1	C2	O7	110.664
C2	C1	H4	109.080	C2	C1	H5	109.489
C2	C1	H6	109.489	C2	O7	H8	110.413
O3	C2	O7	121.666	H4	C1	H5	110.313
H4	C1	H6	110.313	H5	C1	H6	108.140

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

using model chemistry: MP2/CEP-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: MP2/CEP-31G

States and conformations

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