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	hartrees
Energy at 0K	-154.796604
Energy at 298.15K	-154.803251
Nuclear repulsion energy	81.813027

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3843	3725
2	A'	3130	3033
3	A'	3047	2954
4	A'	3002	2909
5	A'	1536	1489
6	A'	1508	1461
7	A'	1464	1419
8	A'	1401	1357
9	A'	1280	1241
10	A'	1115	1081
11	A'	1048	1016
12	A'	906	878
13	A'	412	399
14	A"	3135	3038
15	A"	3038	2944
16	A"	1490	1444
17	A"	1304	1264
18	A"	1184	1148
19	A"	818	793
20	A"	283	274
21	A"	237	230

Atom	x (Å)	y (Å)	z (Å)
C1	1.171	-0.404	0.000
C2	0.000	0.558	0.000
O3	-1.195	-0.222	0.000
H4	-1.939	0.386	0.000
H5	2.116	0.143	0.000
H6	1.136	-1.040	0.885
H7	1.136	-1.040	-0.885
H8	0.044	1.202	0.886
H9	0.044	1.202	-0.886

	C1	C2	O3	H4	H5	H6	H7	H8	H9
C1		1.5155	2.3736	3.2092	1.0917	1.0908	1.0908	2.1530	2.1530
C2	1.5155		1.4278	1.9469	2.1565	2.1516	2.1516	1.0966	1.0966
O3	2.3736	1.4278		0.9613	3.3317	2.6245	2.6245	2.0863	2.0863
H4	3.2092	1.9469	0.9613		4.0627	3.5038	3.5038	2.3206	2.3206
H5	1.0917	2.1565	3.3317	4.0627		1.7732	1.7732	2.4902	2.4902
H6	1.0908	2.1516	2.6245	3.5038	1.7732		1.7701	2.4945	3.0594
H7	1.0908	2.1516	2.6245	3.5038	1.7732	1.7701		3.0594	2.4945
H8	2.1530	1.0966	2.0863	2.3206	2.4902	2.4945	3.0594		1.7725
H9	2.1530	1.0966	2.0863	2.3206	2.4902	3.0594	2.4945	1.7725

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	107.458	C1	C2	H8	109.987
C1	C2	H9	109.987	C2	C1	H5	110.554
C2	C1	H6	110.216	C2	C1	H7	110.216
C2	O3	H4	107.548	O3	C2	H8	110.790
O3	C2	H9	110.790	H5	C1	H6	108.671
H5	C1	H7	108.671	H6	C1	H7	108.458
H8	C2	H9	107.840

All results from a given calculation for CH₃CH₂OH (Ethanol)

using model chemistry: MP4/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 CH3CH2OH (Ethanol)

using model chemistry: MP4/cc-pVTZ

States and conformations

All results from a given calculation for CH₃CH₂OH (Ethanol)