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	hartrees
Energy at 0K	-153.960916
Energy at 298.15K	-153.965938
HF Energy	-153.470724
Nuclear repulsion energy	74.784404

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3903	3690	50.93
2	A	3203	3028	52.94
3	A	3186	3012	5.30
4	A	3143	2972	19.35
5	A	3056	2889	32.78
6	A	1538	1454	1.52
7	A	1513	1431	7.85
8	A	1491	1409	19.43
9	A	1432	1354	2.61
10	A	1301	1230	108.28
11	A	1221	1154	46.44
12	A	1085	1026	28.09
13	A	1066	1008	11.98
14	A	950	898	11.09
15	A	663	627	14.89
16	A	418	395	11.04
17	A	355	336	144.53
18	A	190	180	6.20

Atom	x (Å)	y (Å)	z (Å)
C1	-0.088	0.518	-0.113
C2	1.228	-0.168	0.013
O3	-1.167	-0.342	0.024
H4	-0.227	1.519	0.285
H5	1.285	-1.008	-0.682
H6	2.038	0.527	-0.212
H7	1.386	-0.563	1.025
H8	-1.985	0.166	-0.011

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.4898	1.3861	1.0863	2.1302	2.1282	2.1528	1.9320
C2	1.4898		2.4015	2.2448	1.0914	1.0905	1.0972	3.2308
O3	1.3861	2.4015		2.1008	2.6374	3.3286	2.7511	0.9635
H4	1.0863	2.2448	2.1008		3.0995	2.5223	2.7356	2.2380
H5	2.1302	1.0914	2.6374	3.0995		1.7722	1.7669	3.5389
H6	2.1282	1.0905	3.3286	2.5223	1.7722		1.7725	4.0440
H7	2.1528	1.0972	2.7511	2.7356	1.7669	1.7725		3.6012
H8	1.9320	3.2308	0.9635	2.2380	3.5389	4.0440	3.6012

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.279	C1	C2	H6	110.178
C1	C2	H7	111.748	C1	O3	H8	109.308
C2	C1	O3	113.192	C2	C1	H4	120.441
O3	C1	H4	115.838	H5	C2	H6	108.630
H5	C2	H7	107.672	H6	C2	H7	108.236

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

using model chemistry: QCISD/6-31+G**

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/6-31+G**

States and conformations

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