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	hartrees
Energy at 0K	-154.034256
Energy at 298.15K	-154.039266
HF Energy	-153.474632
Nuclear repulsion energy	75.033508

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3917	3703	50.31
2	A	3184	3011	43.13
3	A	3170	2997	4.96
4	A	3128	2958	15.89
5	A	3046	2880	23.84
6	A	1527	1443	1.83
7	A	1503	1421	8.00
8	A	1487	1406	16.09
9	A	1422	1345	0.45
10	A	1318	1246	132.43
11	A	1238	1171	25.38
12	A	1082	1023	22.92
13	A	1051	993	8.19
14	A	947	896	7.64
15	A	647	612	14.42
16	A	409	387	10.20
17	A	368	347	122.19
18	A	184	174	3.07

Atom	x (Å)	y (Å)	z (Å)
C1	-0.096	0.512	-0.110
C2	1.226	-0.164	0.013
O3	-1.162	-0.343	0.023
H4	-0.233	1.519	0.276
H5	1.283	-1.014	-0.673
H6	2.032	0.531	-0.227
H7	1.400	-0.550	1.027
H8	-1.968	0.173	-0.005

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.4905	1.3727	1.0876	2.1323	2.1320	2.1585	1.9047
C2	1.4905		2.3946	2.2432	1.0931	1.0915	1.0984	3.2117
O3	1.3727	2.3946		2.0967	2.6290	3.3211	2.7589	0.9576
H4	1.0876	2.2432	2.0967		3.1006	2.5222	2.7402	2.2141
H5	2.1323	1.0931	2.6290	3.1006		1.7735	1.7658	3.5245
H6	2.1320	1.0915	3.3211	2.5222	1.7735		1.7723	4.0223
H7	2.1585	1.0984	2.7589	2.7402	1.7658	1.7723		3.5957
H8	1.9047	3.2117	0.9576	2.2141	3.5245	4.0223	3.5957

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.295	C1	C2	H6	110.375
C1	C2	H7	112.083	C1	O3	H8	108.324
C2	C1	O3	113.444	C2	C1	H4	120.136
O3	C1	H4	116.429	H5	C2	H6	108.547
H5	C2	H7	107.365	H6	C2	H7	108.052

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

using model chemistry: CCSD/6-31G(2df,p)

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: CCSD/6-31G(2df,p)

States and conformations

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