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	hartrees
Energy at 0K	-154.180422
Energy at 298.15K	-154.185431
HF Energy	-153.518497
Nuclear repulsion energy	75.202358

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3875	3708
2	A	3170	3033
3	A	3125	2991
4	A	3079	2947
5	A	2998	2869
6	A	1511	1446
7	A	1488	1424
8	A	1475	1411
9	A	1403	1342
10	A	1294	1238
11	A	1226	1173
12	A	1073	1027
13	A	1037	992
14	A	940	899
15	A	606	580
16	A	410	392
17	A	371	355
18	A	193	185

Atom	x (Å)	y (Å)	z (Å)
C1	-0.090	0.509	-0.104
C2	1.223	-0.165	0.013
O3	-1.163	-0.342	0.020
H4	-0.229	1.518	0.255
H5	1.278	-1.007	-0.675
H6	2.025	0.530	-0.225
H7	1.397	-0.553	1.022
H8	-1.966	0.182	0.009

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.4807	1.3741	1.0799	2.1208	2.1190	2.1466	1.9072
C2	1.4807		2.3921	2.2355	1.0890	1.0871	1.0951	3.2078
O3	1.3741	2.3921		2.0940	2.6237	3.3135	2.7569	0.9590
H4	1.0799	2.2355	2.0940		3.0842	2.5073	2.7421	2.2051
H5	2.1208	1.0890	2.6237	3.0842		1.7669	1.7608	3.5225
H6	2.1190	1.0871	3.3135	2.5073	1.7669		1.7665	4.0129
H7	2.1466	1.0951	2.7569	2.7421	1.7608	1.7665		3.5882
H8	1.9072	3.2078	0.9590	2.2051	3.5225	4.0129	3.5882

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.309	C1	C2	H6	110.279
C1	C2	H7	112.022	C1	O3	H8	108.343
C2	C1	O3	113.792	C2	C1	H4	120.824
O3	C1	H4	116.638	H5	C2	H6	108.574
H5	C2	H7	107.449	H6	C2	H7	108.092

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

using model chemistry: QCISD(T)=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 CH3CHOH (1-hydroxy-ethyl radical)

using model chemistry: QCISD(T)=FULL/cc-pVTZ

States and conformations

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