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	hartrees
Energy at 0K	-251.954391
Energy at 298.15K
HF Energy	-251.536804
Nuclear repulsion energy	129.748621

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	3510	3339	7.10	50.82	0.27	0.42
2	A	3186	3031	39.16	45.53	0.63	0.77
3	A	3178	3023	18.43	72.61	0.44	0.61
4	A	3125	2973	22.99	83.02	0.16	0.28
5	A	3073	2924	37.82	88.94	0.23	0.37
6	A	1613	1535	1.34	9.23	0.74	0.85
7	A	1605	1527	0.53	15.59	0.74	0.85
8	A	1478	1406	5.95	2.63	0.70	0.82
9	A	1460	1389	33.49	6.50	0.70	0.83
10	A	1439	1369	18.56	16.97	0.75	0.86
11	A	1297	1234	8.31	13.12	0.73	0.84
12	A	1267	1206	16.56	11.03	0.75	0.86
13	A	1162	1106	5.18	3.42	0.54	0.70
14	A	1072	1020	28.85	6.38	0.65	0.79
15	A	1030	980	40.70	1.51	0.69	0.82
16	A	910	865	11.10	4.36	0.60	0.75
17	A	885	842	30.30	9.19	0.21	0.35
18	A	524	499	60.73	5.58	0.75	0.86
19	A	500	476	123.52	2.01	0.74	0.85
20	A	310	295	2.51	0.18	0.53	0.70
21	A	180	171	14.95	0.09	0.60	0.75

Atom	x (Å)	y (Å)	z (Å)
C1	0.697	0.630	0.281
C2	-0.722	0.610	-0.281
O3	1.397	-0.574	-0.188
F4	-1.296	-0.639	0.165
H5	1.254	1.489	-0.094
H6	0.650	0.679	1.376
H7	-1.331	1.440	0.083
H8	-0.695	0.605	-1.372
H9	0.765	-1.314	0.019

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5263	1.4693	2.3656	1.0904	1.0977	2.1930	2.1607	1.9627
C2	1.5263		2.4292	1.4457	2.1709	2.1528	1.0918	1.0914	2.4505
O3	1.4693	2.4292		2.7165	2.0700	2.1383	3.4018	2.6770	0.9946
F4	2.3656	1.4457	2.7165		3.3317	2.6440	2.0815	2.0671	2.1736
H5	1.0904	2.1709	2.0700	3.3317		1.7844	2.5920	2.4925	2.8476
H6	1.0977	2.1528	2.1383	2.6440	1.7844		2.4860	3.0606	2.4135
H7	2.1930	1.0918	3.4018	2.0815	2.5920	2.4860		1.7942	3.4619
H8	2.1607	1.0914	2.6770	2.0671	2.4925	3.0606	1.7942		2.7836
H9	1.9627	2.4505	0.9946	2.1736	2.8476	2.4135	3.4619	2.7836

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	105.461	C1	C2	H7	112.731
C1	C2	H8	110.153	C1	O3	H9	103.939
C2	C1	O3	108.360	C2	C1	H5	111.030
C2	C1	H6	109.166	O3	C1	H5	107.008
O3	C1	H6	112.001

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

using model chemistry: MP2/3-21G*

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: MP2/3-21G*

States and conformations

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