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	hartrees
Energy at 0K	-153.569978
Energy at 298.15K	-153.574156
HF Energy	-152.956079
Nuclear repulsion energy	70.612059

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3839	3645	45.69
2	A'	3312	3145	4.19
3	A'	3255	3090	3.72
4	A'	3218	3055	4.89
5	A'	1721	1634	147.77
6	A'	1468	1394	15.60
7	A'	1374	1304	5.49
8	A'	1339	1272	3.84
9	A'	1131	1073	182.78
10	A'	971	922	8.09
11	A'	491	466	13.48
12	A"	1016	965	34.77
13	A"	846	803	63.44
14	A"	731	694	0.37
15	A"	467	444	94.35

Atom	x (Å)	y (Å)
C1	1.208	-0.112
C2	0.000	0.441
O3	-1.190	-0.208
H4	1.344	-1.180
H5	2.078	0.517
H6	-0.142	1.507
H7	-1.013	-1.154

	C1	C2	O3	H4	H5	H6	H7
C1		1.3286	2.3999	1.0768	1.0727	2.1076	2.4540
C2	1.3286		1.3552	2.1057	2.0792	1.0753	1.8898
O3	2.3999	1.3552		2.7139	3.3469	2.0099	0.9624
H4	1.0768	2.1057	2.7139		1.8481	3.0702	2.3577
H5	1.0727	2.0792	3.3469	1.8481		2.4304	3.5137
H6	2.1076	1.0753	2.0099	3.0702	2.4304		2.8002
H7	2.4540	1.8898	0.9624	2.3577	3.5137	2.8002

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	126.808	C1	C2	H6	122.145
C2	C1	H4	121.832	C2	C1	H5	119.581
C2	O3	H7	108.054	O3	C2	H6	111.047
H4	C1	H5	118.587

All results from a given calculation for CH₂CHOH (ethenol)

using model chemistry: MP2=FULL/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 CH2CHOH (ethenol)

using model chemistry: MP2=FULL/cc-pVTZ

States and conformations

All results from a given calculation for CH₂CHOH (ethenol)