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	hartrees
Energy at 0K	-154.223914
Energy at 298.15K
HF Energy	-154.072949
Nuclear repulsion energy	74.964272

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3872	3872	40.39
2	A	3176	3176	53.35
3	A	3161	3161	14.71
4	A	3119	3119	21.47
5	A	3029	3029	35.31
6	A	1532	1532	1.23
7	A	1507	1507	7.99
8	A	1484	1484	19.16
9	A	1425	1425	0.96
10	A	1300	1300	127.89
11	A	1231	1231	33.43
12	A	1079	1079	27.95
13	A	1052	1052	12.43
14	A	948	948	8.73
15	A	641	641	15.69
16	A	415	415	11.98
17	A	371	371	135.65
18	A	187	187	3.31

Atom	x (Å)	y (Å)	z (Å)
C1	-0.092	0.511	-0.108
C2	1.225	-0.165	0.012
O3	-1.165	-0.342	0.024
H4	-0.225	1.520	0.275
H5	1.282	-1.014	-0.673
H6	2.031	0.528	-0.231
H7	1.407	-0.552	1.024
H8	-1.976	0.176	-0.016

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.4853	1.3777	1.0875	2.1289	2.1263	2.1580	1.9164
C2	1.4853		2.3970	2.2393	1.0922	1.0905	1.0985	3.2198
O3	1.3777	2.3970		2.1010	2.6317	3.3225	2.7673	0.9633
H4	1.0875	2.2393	2.1010		3.0973	2.5162	2.7422	2.2264
H5	2.1289	1.0922	2.6317	3.0973		1.7709	1.7631	3.5303
H6	2.1263	1.0905	3.3225	2.5162	1.7709		1.7695	4.0285
H7	2.1580	1.0985	2.7673	2.7422	1.7631	1.7695		3.6134
H8	1.9164	3.2198	0.9633	2.2264	3.5303	4.0285	3.6134

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.439	C1	C2	H6	110.336
C1	C2	H7	112.414	C1	O3	H8	108.596
C2	C1	O3	113.645	C2	C1	H4	120.209
O3	C1	H4	116.418	H5	C2	H6	108.447
H5	C2	H7	107.184	H6	C2	H7	107.874

All results from a given calculation for CH₃CHOH (1-hydroxy-ethyl radical)

using model chemistry: B2PLYP=FULLultrafine/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 CH3CHOH (1-hydroxy-ethyl radical)

using model chemistry: B2PLYP=FULLultrafine/6-31G**

States and conformations

All results from a given calculation for CH₃CHOH (1-hydroxy-ethyl radical)