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	hartrees
Energy at 0K	-253.893278
Energy at 298.15K
HF Energy	-253.029606
Nuclear repulsion energy	131.166559

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3894	3713	42.86
2	A	3142	2996	28.00
3	A	3118	2973	25.71
4	A	3078	2936	22.92
5	A	3042	2902	35.33
6	A	1525	1454	3.09
7	A	1519	1449	4.10
8	A	1460	1392	25.18
9	A	1426	1360	20.45
10	A	1404	1339	2.78
11	A	1293	1233	8.33
12	A	1242	1184	13.83
13	A	1155	1102	34.06
14	A	1133	1080	61.08
15	A	1082	1032	73.29
16	A	915	873	13.39
17	A	882	841	32.13
18	A	525	500	11.04
19	A	379	361	94.99
20	A	316	301	34.74
21	A	160	152	10.94

Atom	x (Å)	y (Å)	z (Å)
C1	0.680	0.574	0.285
C2	-0.719	0.554	-0.282
O3	1.453	-0.506	-0.191
F4	-1.357	-0.601	0.157
H5	1.182	1.489	-0.034
H6	0.628	0.573	1.379
H7	-1.301	1.411	0.062
H8	-0.700	0.522	-1.372
H9	1.008	-1.317	0.059

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5093	1.4110	2.3547	1.0910	1.0954	2.1613	2.1568	1.9329
C2	1.5093		2.4185	1.3905	2.1329	2.1388	1.0914	1.0904	2.5690
O3	1.4110	2.4185		2.8332	2.0192	2.0760	3.3646	2.6625	0.9587
F4	2.3547	1.3905	2.8332		3.2937	2.6099	2.0144	2.0078	2.4730
H5	1.0910	2.1329	2.0192	3.2937		1.7721	2.4857	2.5036	2.8130
H6	1.0954	2.1388	2.0760	2.6099	1.7721		2.4810	3.0553	2.3369
H7	2.1613	1.0914	3.3646	2.0144	2.4857	2.4810		1.7908	3.5737
H8	2.1568	1.0904	2.6625	2.0078	2.5036	3.0553	1.7908		2.8894
H9	1.9329	2.5690	0.9587	2.4730	2.8130	2.3369	3.5737	2.8894

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.515	C1	C2	H7	111.400
C1	C2	H8	111.099	C1	O3	H9	107.780
C2	C1	O3	111.780	C2	C1	H5	109.155
C2	C1	H6	109.371	O3	C1	H5	106.918
O3	C1	H6	111.225

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

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

States and conformations

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