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	hartrees
Energy at 0K	-253.290535
Energy at 298.15K
HF Energy	-252.833153
Nuclear repulsion energy	128.087673

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3621	3489	12.35
2	A	3128	3014	32.54
3	A	3103	2990	22.23
4	A	3061	2950	20.22
5	A	3017	2907	34.31
6	A	1554	1498	1.99
7	A	1550	1494	0.97
8	A	1436	1384	24.85
9	A	1429	1377	7.52
10	A	1402	1351	16.64
11	A	1255	1209	14.74
12	A	1220	1175	8.10
13	A	1132	1090	6.38
14	A	1070	1031	42.55
15	A	1007	971	35.91
16	A	887	855	22.09
17	A	858	826	42.61
18	A	510	491	14.83
19	A	434	418	196.12
20	A	315	303	13.25
21	A	156	151	16.14

Atom	x (Å)	y (Å)	z (Å)
C1	0.685	0.606	0.301
C2	-0.717	0.603	-0.296
O3	1.458	-0.537	-0.196
F4	-1.365	-0.633	0.163
H5	1.242	1.500	-0.015
H6	0.623	0.593	1.403
H7	-1.334	1.445	0.050
H8	-0.690	0.560	-1.393
H9	0.979	-1.362	0.032

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5241	1.4666	2.3998	1.0987	1.1042	2.2004	2.1820	2.0080
C2	1.5241		2.4574	1.4685	2.1729	2.1639	1.0993	1.0981	2.6161
O3	1.4666	2.4574		2.8473	2.0560	2.1289	3.4321	2.6918	0.9809
F4	2.3998	1.4685	2.8473		3.3727	2.6449	2.0812	2.0730	2.4583
H5	1.0987	2.1729	2.0560	3.3727		1.7927	2.5766	2.5523	2.8739
H6	1.1042	2.1639	2.1289	2.6449	1.7927		2.5270	3.0889	2.4141
H7	2.2004	1.0993	3.4321	2.0812	2.5766	2.5270		1.8105	3.6367
H8	2.1820	1.0981	2.6918	2.0730	2.5523	3.0889	1.8105		2.9168
H9	2.0080	2.6161	0.9809	2.4583	2.8739	2.4141	3.6367	2.9168

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	106.613	C1	C2	H7	113.019
C1	C2	H8	111.600	C1	O3	H9	108.630
C2	C1	O3	110.497	C2	C1	H5	110.842
C2	C1	H6	109.810	O3	C1	H5	105.648
O3	C1	H6	111.029

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

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

States and conformations

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