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	hartrees
Energy at 0K	-154.022557
Energy at 298.15K	-154.027566
HF Energy	-153.514665
Nuclear repulsion energy	75.034449

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3916	3712	49.44
2	A	3184	3018	49.76
3	A	3161	2997	7.08
4	A	3119	2957	19.13
5	A	3036	2878	29.88
6	A	1524	1444	3.17
7	A	1497	1419	21.32
8	A	1490	1412	5.87
9	A	1430	1356	0.29
10	A	1320	1251	129.75
11	A	1236	1172	40.50
12	A	1087	1031	28.33
13	A	1060	1005	9.10
14	A	949	900	10.26
15	A	652	618	14.68
16	A	422	400	10.10
17	A	340	322	131.30
18	A	186	176	7.63

Atom	x (Å)	y (Å)	z (Å)
C1	-0.093	0.509	-0.109
C2	1.227	-0.165	0.013
O3	-1.165	-0.341	0.024
H4	-0.228	1.515	0.275
H5	1.286	-1.012	-0.674
H6	2.029	0.533	-0.228
H7	1.397	-0.546	1.028
H8	-1.971	0.177	-0.015

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.4870	1.3749	1.0857	2.1289	2.1255	2.1503	1.9104
C2	1.4870		2.3984	2.2385	1.0914	1.0903	1.0971	3.2169
O3	1.3749	2.3984		2.0945	2.6351	3.3212	2.7589	0.9593
H4	1.0857	2.2385	2.0945		3.0951	2.5128	2.7304	2.2172
H5	2.1289	1.0914	2.6351	3.0951		1.7715	1.7676	3.5294
H6	2.1255	1.0903	3.3212	2.5128	1.7715		1.7713	4.0223
H7	2.1503	1.0971	2.7589	2.7304	1.7676	1.7713		3.5995
H8	1.9104	3.2169	0.9593	2.2172	3.5294	4.0223	3.5995

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.366	C1	C2	H6	110.164
C1	C2	H7	111.750	C1	O3	H8	108.545
C2	C1	O3	113.813	C2	C1	H4	120.134
O3	C1	H4	116.190	H5	C2	H6	108.582
H5	C2	H7	107.730	H6	C2	H7	108.148

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

using model chemistry: CCD/TZVP

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: CCD/TZVP

States and conformations

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