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	hartrees
Energy at 0K	-154.222349
Energy at 298.15K	-154.227374
HF Energy	-153.530472
Nuclear repulsion energy	75.510575

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3883	3717	73.77
2	A	3215	3077	34.09
3	A	3192	3055	3.43
4	A	3140	3005	11.51
5	A	3051	2920	24.83
6	A	1515	1450	2.61
7	A	1490	1426	11.73
8	A	1475	1412	21.27
9	A	1405	1344	0.10
10	A	1288	1233	118.69
11	A	1233	1181	46.39
12	A	1079	1033	28.94
13	A	1041	996	4.84
14	A	951	910	11.44
15	A	614	588	16.69
16	A	417	399	9.32
17	A	378	362	120.51
18	A	192	184	4.20

Atom	x (Å)	y (Å)	z (Å)
C1	-0.090	0.508	-0.104
C2	1.217	-0.164	0.013
O3	-1.156	-0.340	0.021
H4	-0.230	1.515	0.255
H5	1.279	-0.994	-0.684
H6	2.020	0.530	-0.206
H7	1.381	-0.566	1.014
H8	-1.964	0.172	0.003

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.4736	1.3676	1.0786	2.1134	2.1118	2.1361	1.9075
C2	1.4736		2.3789	2.2300	1.0855	1.0836	1.0911	3.1988
O3	1.3676	2.3789		2.0862	2.6177	3.3000	2.7331	0.9575
H4	1.0786	2.2300	2.0862		3.0754	2.4992	2.7389	2.2076
H5	2.1134	1.0855	2.6177	3.0754		1.7607	1.7537	3.5146
H6	2.1118	1.0836	3.3000	2.4992	1.7607		1.7599	4.0054
H7	2.1361	1.0911	2.7331	2.7389	1.7537	1.7599		3.5715
H8	1.9075	3.1988	0.9575	2.2076	3.5146	4.0054	3.5715

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.430	C1	C2	H6	110.422
C1	C2	H7	111.929	C1	O3	H8	108.971
C2	C1	O3	113.654	C2	C1	H4	121.019
O3	C1	H4	116.546	H5	C2	H6	108.533
H5	C2	H7	107.353	H6	C2	H7	108.049

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

using model chemistry: MP2=FULL/cc-pVQZ

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: MP2=FULL/cc-pVQZ

States and conformations

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