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	hartrees
Energy at 0K	-254.039548
Energy at 298.15K
HF Energy	-253.826739
Nuclear repulsion energy	131.396909

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A	3841	3841	29.05	51.75	0.24	0.39
2	A	3161	3161	44.75	50.49	0.73	0.84
3	A	3142	3142	30.71	80.10	0.39	0.56
4	A	3096	3096	29.60	100.78	0.14	0.25
5	A	3048	3048	48.45	102.75	0.20	0.33
6	A	1544	1544	1.93	5.21	0.73	0.84
7	A	1537	1537	1.60	13.56	0.74	0.85
8	A	1466	1466	36.92	5.00	0.63	0.77
9	A	1438	1438	28.51	3.56	0.73	0.85
10	A	1410	1410	5.86	10.71	0.75	0.86
11	A	1285	1285	8.02	10.95	0.72	0.83
12	A	1246	1246	17.07	7.15	0.75	0.86
13	A	1159	1159	5.43	2.18	0.30	0.46
14	A	1118	1118	89.38	4.62	0.73	0.85
15	A	1076	1076	54.64	1.81	0.63	0.77
16	A	918	918	15.03	6.61	0.33	0.50
17	A	887	887	33.21	4.55	0.42	0.59
18	A	531	531	10.67	1.08	0.74	0.85
19	A	449	449	135.30	3.15	0.74	0.85
20	A	325	325	9.97	0.26	0.58	0.73
21	A	167	167	11.89	0.03	0.35	0.52

Atom	x (Å)	y (Å)	z (Å)
C1	0.690	0.589	0.275
C2	-0.717	0.575	-0.274
O3	1.420	-0.533	-0.185
F4	-1.324	-0.612	0.159
H5	1.215	1.482	-0.069
H6	0.647	0.622	1.371
H7	-1.309	1.419	0.086
H8	-0.710	0.565	-1.366
H9	0.880	-1.303	0.030

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5105	1.4154	2.3476	1.0916	1.0977	2.1726	2.1562	1.9173
C2	1.5105		2.4093	1.4013	2.1448	2.1379	1.0925	1.0915	2.4841
O3	1.4154	2.4093		2.7675	2.0280	2.0864	3.3666	2.6713	0.9656
F4	2.3476	1.4013	2.7675		3.2991	2.6221	2.0323	2.0222	2.3138
H5	1.0916	2.1448	2.0280	3.2991		1.7712	2.5300	2.4950	2.8067
H6	1.0977	2.1379	2.0864	2.6221	1.7712		2.4723	3.0550	2.3574
H7	2.1726	1.0925	3.3666	2.0323	2.5300	2.4723		1.7882	3.4938
H8	2.1562	1.0915	2.6713	2.0222	2.4950	3.0550	1.7882		2.8225
H9	1.9173	2.4841	0.9656	2.3138	2.8067	2.3574	3.4938	2.8225

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	107.398	C1	C2	H7	112.164
C1	C2	H8	110.900	C1	O3	H9	105.712
C2	C1	O3	110.818	C2	C1	H5	109.983
C2	C1	H6	109.084	O3	C1	H5	107.278
O3	C1	H6	111.617

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

using model chemistry: B2PLYP=FULL/6-31G**

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: B2PLYP=FULL/6-31G**

States and conformations

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