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	hartrees
Energy at 0K	-154.671585
Energy at 298.15K	-154.678262
Nuclear repulsion energy	81.768495

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3921	3741	21.74
2	A'	3137	2993	32.62
3	A'	3059	2919	15.64
4	A'	3012	2874	66.35
5	A'	1559	1487	2.24
6	A'	1526	1456	2.33
7	A'	1498	1430	11.03
8	A'	1427	1361	1.21
9	A'	1312	1252	81.88
10	A'	1143	1090	26.22
11	A'	1070	1021	44.49
12	A'	925	882	9.79
13	A'	423	403	10.83
14	A"	3144	2999	35.75
15	A"	3044	2904	60.58
16	A"	1502	1433	4.48
17	A"	1326	1265	0.03
18	A"	1207	1152	4.98
19	A"	835	796	0.18
20	A"	285	272	31.93
21	A"	235	224	92.09

Atom	x (Å)	y (Å)	z (Å)
C1	1.170	-0.413	0.000
C2	0.000	0.557	0.000
O3	-1.197	-0.212	0.000
H4	-1.928	0.406	0.000
H5	2.123	0.129	0.000
H6	1.128	-1.052	0.889
H7	1.128	-1.052	-0.889
H8	0.052	1.203	0.890
H9	0.052	1.203	-0.890

	C1	C2	O3	H4	H5	H6	H7	H8	H9
C1		1.5202	2.3758	3.2051	1.0962	1.0950	1.0950	2.1580	2.1580
C2	1.5202		1.4227	1.9343	2.1652	2.1564	2.1564	1.1011	1.1011
O3	2.3758	1.4227		0.9574	3.3371	2.6269	2.6269	2.0867	2.0867
H4	3.2051	1.9343	0.9574		4.0604	3.5008	3.5008	2.3127	2.3127
H5	1.0962	2.1652	3.3371	4.0604		1.7816	1.7816	2.4968	2.4968
H6	1.0950	2.1564	2.6269	3.5008	1.7816		1.7774	2.4988	3.0672
H7	1.0950	2.1564	2.6269	3.5008	1.7816	1.7774		3.0672	2.4988
H8	2.1580	1.1011	2.0867	2.3127	2.4968	2.4988	3.0672		1.7799
H9	2.1580	1.1011	2.0867	2.3127	2.4968	3.0672	2.4988	1.7799

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	107.618	C1	C2	H8	109.790
C1	C2	H9	109.790	C2	C1	H5	110.653
C2	C1	H6	110.024	C2	C1	H7	110.024
C2	O3	H4	107.096	O3	C2	H8	110.901
O3	C2	H9	110.901	H5	C1	H6	108.797
H5	C1	H7	108.797	H6	C1	H7	108.497
H8	C2	H9	107.843

All results from a given calculation for CH₃CH₂OH (Ethanol)

using model chemistry: QCISD/6-311G**

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 CH3CH2OH (Ethanol)

using model chemistry: QCISD/6-311G**

States and conformations

All results from a given calculation for CH₃CH₂OH (Ethanol)