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	hartrees
Energy at 0K	-152.125613
Energy at 298.15K
HF Energy	-152.078703
Nuclear repulsion energy	73.181902

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3812	3812	20.32
2	A	3521	3521	0.90
3	A	3479	3479	2.53
4	A	3396	3396	9.48
5	A	3325	3325	2.98
6	A	1712	1712	1.63
7	A	1696	1696	3.29
8	A	1621	1621	10.06
9	A	1574	1574	5.32
10	A	1453	1453	71.38
11	A	1290	1290	7.31
12	A	1151	1151	7.05
13	A	1134	1134	7.14
14	A	999	999	2.29
15	A	688	688	6.55
16	A	430	430	65.77
17	A	401	401	17.21
18	A	134	134	1.05

Atom	x (Å)	y (Å)	z (Å)
C1	-0.100	0.519	-0.125
C2	1.259	-0.167	0.016
O3	-1.197	-0.360	0.024
H4	-0.209	1.531	0.307
H5	1.261	-1.124	-0.527
H6	2.050	0.473	-0.404
H7	1.520	-0.377	1.069
H8	-2.001	0.267	0.017

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.5289	1.4144	1.1055	2.1712	2.1678	2.2028	1.9232
C2	1.5289		2.4640	2.2640	1.1005	1.1007	1.1051	3.2888
O3	1.4144	2.4640		2.1524	2.6323	3.3793	2.9115	1.0195
H4	1.1055	2.2640	2.1524		3.1478	2.5939	2.6856	2.2115
H5	2.1712	1.1005	2.6323	3.1478		1.7859	1.7820	3.5875
H6	2.1678	1.1007	3.3793	2.5939	1.7859		1.7814	4.0776
H7	2.2028	1.1051	2.9115	2.6856	1.7820	1.7814		3.7307
H8	1.9232	3.2888	1.0195	2.2115	3.5875	4.0776	3.7307

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.259	C1	C2	H6	109.987
C1	C2	H7	112.505	C1	O3	H8	103.205
C2	C1	O3	113.624	C2	C1	H4	117.607
O3	C1	H4	116.802	H5	C2	H6	108.452
H5	C2	H7	107.787	H6	C2	H7	107.724

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

using model chemistry: B2PLYP=FULLultrafine/STO-3G

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/STO-3G

States and conformations

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