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	hartrees
Energy at 0K	-153.560498
Energy at 298.15K	-153.567171
HF Energy	-153.219848
Nuclear repulsion energy	80.301454

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3452	3348
2	A'	3117	3023
3	A'	3045	2953
4	A'	2981	2891
5	A'	1609	1561
6	A'	1583	1535
7	A'	1482	1437
8	A'	1470	1426
9	A'	1300	1260
10	A'	1114	1080
11	A'	992	962
12	A'	884	857
13	A'	394	382
14	A"	3126	3031
15	A"	3008	2917
16	A"	1565	1518
17	A"	1336	1295
18	A"	1195	1159
19	A"	861	835
20	A"	311	302
21	A"	244	237

Atom	x (Å)	y (Å)	z (Å)
C1	1.192	-0.387	0.000
C2	0.000	0.589	0.000
O3	-1.207	-0.266	0.000
H4	-1.999	0.337	0.000
H5	2.143	0.162	0.000
H6	1.137	-1.025	0.891
H7	1.137	-1.025	-0.891
H8	0.042	1.236	0.893
H9	0.042	1.236	-0.893

	C1	C2	O3	H4	H5	H6	H7	H8	H9
C1		1.5405	2.4015	3.2716	1.0987	1.0972	1.0972	2.1808	2.1808
C2	1.5405		1.4790	2.0144	2.1855	2.1664	2.1664	1.1039	1.1039
O3	2.4015	1.4790		0.9956	3.3774	2.6203	2.6203	2.1484	2.1484
H4	3.2716	2.0144	0.9956		4.1457	3.5335	3.5335	2.4024	2.4024
H5	1.0987	2.1855	3.3774	4.1457		1.7929	1.7929	2.5234	2.5234
H6	1.0972	2.1664	2.6203	3.5335	1.7929		1.7825	2.5128	3.0819
H7	1.0972	2.1664	2.6203	3.5335	1.7929	1.7825		3.0819	2.5128
H8	2.1808	1.1039	2.1484	2.4024	2.5234	2.5128	3.0819		1.7861
H9	2.1808	1.1039	2.1484	2.4024	2.5234	3.0819	2.5128	1.7861

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	105.354	C1	C2	H8	110.009
C1	C2	H9	110.009	C2	C1	H5	110.691
C2	C1	H6	109.274	C2	C1	H7	109.274
C2	O3	H4	107.373	O3	C2	H8	111.736
O3	C2	H9	111.736	H5	C1	H6	109.463
H5	C1	H7	109.463	H6	C1	H7	108.642
H8	C2	H9	107.992

All results from a given calculation for CH₃CH₂OH (Ethanol)

using model chemistry: MP4/3-21G

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: MP4/3-21G

States and conformations

All results from a given calculation for CH₃CH₂OH (Ethanol)