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	hartrees
Energy at 0K	-253.884744
Energy at 298.15K
HF Energy	-253.030028
Nuclear repulsion energy	131.445461

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3944	3944	49.40
2	A	3166	3166	27.25
3	A	3145	3145	23.89
4	A	3102	3102	22.07
5	A	3067	3067	34.16
6	A	1531	1531	3.44
7	A	1525	1525	4.35
8	A	1468	1468	26.57
9	A	1435	1435	21.93
10	A	1412	1412	2.71
11	A	1305	1305	8.45
12	A	1250	1250	14.52
13	A	1169	1169	56.96
14	A	1143	1143	41.57
15	A	1103	1103	75.91
16	A	921	921	12.21
17	A	890	890	29.01
18	A	528	528	11.25
19	A	380	380	95.35
20	A	317	317	37.32
21	A	159	159	11.06

Atom	x (Å)	y (Å)	z (Å)
C1	0.680	0.573	0.283
C2	-0.720	0.550	-0.281
O3	1.452	-0.504	-0.190
F4	-1.354	-0.599	0.158
H5	1.177	1.488	-0.036
H6	0.629	0.575	1.376
H7	-1.299	1.408	0.061
H8	-0.700	0.520	-1.369
H9	1.010	-1.314	0.059

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5094	1.4073	2.3506	1.0892	1.0937	2.1584	2.1538	1.9293
C2	1.5094		2.4157	1.3836	2.1307	2.1368	1.0898	1.0889	2.5661
O3	1.4073	2.4157		2.8288	2.0166	2.0723	3.3588	2.6590	0.9558
F4	2.3506	1.3836	2.8288		3.2863	2.6066	2.0097	2.0028	2.4721
H5	1.0892	2.1307	2.0166	3.2863		1.7683	2.4790	2.4981	2.8088
H6	1.0937	2.1368	2.0723	2.6066	1.7683		2.4771	3.0507	2.3345
H7	2.1584	1.0898	3.3588	2.0097	2.4790	2.4771		1.7867	3.5693
H8	2.1538	1.0889	2.6590	2.0028	2.4981	3.0507	1.7867		2.8864
H9	1.9293	2.5661	0.9558	2.4721	2.8088	2.3345	3.5693	2.8864

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.609	C1	C2	H7	111.263
C1	C2	H8	110.941	C1	O3	H9	107.926
C2	C1	O3	111.785	C2	C1	H5	109.088
C2	C1	H6	109.304	O3	C1	H5	107.067
O3	C1	H6	111.286

All results from a given calculation for CH₂FCH₂OH (2-fluoroethanol)

using model chemistry: MP3/6-311+G(3df,2p)

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 CH2FCH2OH (2-fluoroethanol)

using model chemistry: MP3/6-311+G(3df,2p)

States and conformations

All results from a given calculation for CH₂FCH₂OH (2-fluoroethanol)