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	hartrees
Energy at 0K	-253.776405
Energy at 298.15K
HF Energy	-253.033404
Nuclear repulsion energy	132.159525

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	4036	3753	55.47
2	A	3238	3011	35.30
3	A	3215	2989	31.46
4	A	3177	2954	23.48
5	A	3139	2918	38.99
6	A	1577	1467	2.84
7	A	1570	1460	3.60
8	A	1518	1412	28.01
9	A	1481	1377	23.33
10	A	1454	1351	8.43
11	A	1342	1248	9.98
12	A	1286	1195	14.99
13	A	1206	1121	60.09
14	A	1179	1096	45.34
15	A	1134	1054	79.52
16	A	949	882	13.38
17	A	916	852	33.66
18	A	543	505	11.84
19	A	395	367	102.62
20	A	325	302	34.52
21	A	160	149	11.48

Atom	x (Å)	y (Å)	z (Å)
C1	0.677	0.570	0.280
C2	-0.716	0.548	-0.278
O3	1.444	-0.503	-0.188
F4	-1.348	-0.596	0.156
H5	1.171	1.479	-0.041
H6	0.630	0.579	1.365
H7	-1.289	1.401	0.064
H8	-0.699	0.524	-1.359
H9	1.001	-1.307	0.055

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5010	1.3993	2.3405	1.0821	1.0865	2.1451	2.1403	1.9180
C2	1.5010		2.4039	1.3765	2.1175	2.1237	1.0825	1.0816	2.5493
O3	1.3993	2.4039		2.8151	2.0055	2.0602	3.3399	2.6493	0.9492
F4	2.3405	1.3765	2.8151		3.2691	2.5986	1.9992	1.9922	2.4569
H5	1.0821	2.1175	2.0055	3.2691		1.7545	2.4631	2.4792	2.7920
H6	1.0865	2.1237	2.0602	2.5986	1.7545		2.4593	3.0311	2.3261
H7	2.1451	1.0825	3.3399	1.9992	2.4631	2.4593		1.7721	3.5459
H8	2.1403	1.0816	2.6493	1.9922	2.4792	3.0311	1.7721		2.8703
H9	1.9180	2.5493	0.9492	2.4569	2.7920	2.3261	3.5459	2.8703

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.778	C1	C2	H7	111.231
C1	C2	H8	110.900	C1	O3	H9	107.970
C2	C1	O3	111.919	C2	C1	H5	109.044
C2	C1	H6	109.274	O3	C1	H5	107.151
O3	C1	H6	111.331

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

using model chemistry: CISD/cc-pVTZ

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: CISD/cc-pVTZ

States and conformations

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