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	hartrees
Energy at 0K	-153.904141
Energy at 298.15K	-153.909179
HF Energy	-153.450553
Nuclear repulsion energy	74.675377

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3776	3596	36.26
2	A	3156	3006	53.71
3	A	3142	2992	13.43
4	A	3107	2958	21.83
5	A	3024	2880	29.41
6	A	1544	1471	1.44
7	A	1521	1448	7.58
8	A	1498	1427	16.54
9	A	1439	1371	0.58
10	A	1325	1262	128.06
11	A	1231	1172	32.99
12	A	1096	1043	22.51
13	A	1072	1021	13.66
14	A	954	908	8.76
15	A	672	640	14.84
16	A	417	397	13.13
17	A	372	354	144.23
18	A	192	183	3.91

Atom	x (Å)	y (Å)	z (Å)
C1	-0.091	0.518	-0.113
C2	1.227	-0.167	0.013
O3	-1.166	-0.344	0.026
H4	-0.225	1.525	0.290
H5	1.279	-1.016	-0.681
H6	2.042	0.527	-0.224
H7	1.394	-0.560	1.029
H8	-1.984	0.176	-0.025

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.4905	1.3851	1.0929	2.1335	2.1354	2.1613	1.9260
C2	1.4905		2.3997	2.2469	1.0972	1.0961	1.1028	3.2298
O3	1.3851	2.3997		2.1089	2.6326	3.3334	2.7583	0.9711
H4	1.0929	2.2469	2.1089		3.1083	2.5295	2.7410	2.2387
H5	2.1335	1.0972	2.6326	3.1083		1.7809	1.7737	3.5358
H6	2.1354	1.0961	3.3334	2.5295	1.7809		1.7806	4.0461
H7	2.1613	1.1028	2.7583	2.7410	1.7737	1.7806		3.6149
H8	1.9260	3.2298	0.9711	2.2387	3.5358	4.0461	3.6149

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.147	C1	C2	H6	110.358
C1	C2	H7	112.037	C1	O3	H8	108.372
C2	C1	O3	113.075	C2	C1	H4	120.068
O3	C1	H4	116.154	H5	C2	H6	108.574
H5	C2	H7	107.460	H6	C2	H7	108.150

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

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 CH3CHOH (1-hydroxy-ethyl radical)

using model chemistry: QCISD/6-31G*

States and conformations

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