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	hartrees
Energy at 0K	-228.469334
Energy at 298.15K	-228.474214
HF Energy	-227.818940
Nuclear repulsion energy	120.856706

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3819	3568	59.99
2	A'	3289	3074	3.82
3	A'	3157	2950	1.42
4	A'	1862	1740	232.43
5	A'	1535	1434	12.08
6	A'	1466	1370	67.19
7	A'	1382	1292	43.80
8	A'	1232	1151	193.76
9	A'	1032	964	65.64
10	A'	888	830	3.10
11	A'	584	546	44.21
12	A'	427	399	3.96
13	A"	3250	3037	3.22
14	A"	1539	1438	7.93
15	A"	1098	1026	6.44
16	A"	691	645	118.56
17	A"	555	519	18.62
18	A"	90	84	0.51

Atom	x (Å)	y (Å)	z (Å)
C1	1.069	-0.898	0.000
C2	0.000	0.155	0.000
O3	0.174	1.359	0.000
H4	2.042	-0.422	0.000
H5	0.959	-1.529	0.878
H6	0.959	-1.529	-0.878
O7	-1.238	-0.408	0.000
H8	-1.860	0.336	0.000

	C1	C2	O3	H4	H5	H6	O7	H8
C1		1.5000	2.4276	1.0830	1.0868	1.0868	2.3578	3.1782
C2	1.5000		1.2165	2.1217	2.1276	2.1276	1.3598	1.8691
O3	2.4276	1.2165		2.5810	3.1191	3.1191	2.2617	2.2767
H4	1.0830	2.1217	2.5810		1.7798	1.7798	3.2795	3.9750
H5	1.0868	2.1276	3.1191	1.7798		1.7555	2.6179	3.4928
H6	1.0868	2.1276	3.1191	1.7798	1.7555		2.6179	3.4928
O7	2.3578	1.3598	2.2617	3.2795	2.6179	2.6179		0.9704
H8	3.1782	1.8691	2.2767	3.9750	3.4928	3.4928	0.9704

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	126.351	C1	C2	O7	110.971
C2	C1	H4	109.396	C2	C1	H5	109.632
C2	C1	H6	109.632	C2	O7	H8	105.439
O3	C2	O7	122.677	H4	C1	H5	110.217
H4	C1	H6	110.217	H5	C1	H6	107.725

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

using model chemistry: MP2=FULL/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: MP2=FULL/6-31G**

States and conformations

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