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	hartrees
Energy at 0K	-153.154368
Energy at 298.15K	-153.158436
Nuclear repulsion energy	68.721969

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3622	3490	10.91
2	A'	3235	3117	19.01
3	A'	3209	3092	1.52
4	A'	3134	3019	5.51
5	A'	1690	1628	71.22
6	A'	1484	1430	13.74
7	A'	1373	1323	0.98
8	A'	1342	1293	8.09
9	A'	1093	1053	142.22
10	A'	937	903	42.71
11	A'	479	461	14.19
12	A"	974	939	41.92
13	A"	854	823	65.37
14	A"	682	657	0.18
15	A"	417	401	182.14

Atom	x (Å)	y (Å)
C1	1.242	-0.069
C2	0.000	0.460
O3	-1.216	-0.260
H4	1.427	-1.147
H5	2.118	0.580
H6	-0.210	1.529
H7	-1.060	-1.228

	C1	C2	O3	H4	H5	H6	H7
C1		1.3501	2.4655	1.0938	1.0897	2.1591	2.5777
C2	1.3501		1.4133	2.1492	2.1209	1.0890	1.9936
O3	2.4655	1.4133		2.7876	3.4377	2.0524	0.9802
H4	1.0938	2.1492	2.7876		1.8600	3.1368	2.4885
H5	1.0897	2.1209	3.4377	1.8600		2.5136	3.6562
H6	2.1591	1.0890	2.0524	3.1368	2.5136		2.8849
H7	2.5777	1.9936	0.9802	2.4885	3.6562	2.8849

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	126.274	C1	C2	H6	124.198
C2	C1	H4	122.799	C2	C1	H5	120.377
C2	O3	H7	111.516	O3	C2	H6	109.528
H4	C1	H5	116.825

All results from a given calculation for CH₂CHOH (ethenol)

using model chemistry: QCISD/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 CH2CHOH (ethenol)

using model chemistry: QCISD/6-31G

States and conformations

All results from a given calculation for CH₂CHOH (ethenol)