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	hartrees
Energy at 0K	-253.771071
Energy at 298.15K
HF Energy	-253.030646
Nuclear repulsion energy	132.153291

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	4058	3741	60.66
2	A	3237	2984	29.67
3	A	3213	2961	28.37
4	A	3174	2926	22.20
5	A	3137	2892	36.51
6	A	1579	1455	3.09
7	A	1572	1449	4.84
8	A	1517	1398	25.41
9	A	1477	1361	20.95
10	A	1450	1336	7.57
11	A	1342	1237	9.97
12	A	1281	1181	15.82
13	A	1206	1112	60.34
14	A	1176	1084	49.14
15	A	1132	1043	84.20
16	A	949	874	12.61
17	A	915	843	32.87
18	A	543	500	12.36
19	A	387	356	95.68
20	A	323	298	43.35
21	A	164	151	11.33

Atom	x (Å)	y (Å)	z (Å)
C1	0.677	0.569	0.281
C2	-0.717	0.546	-0.278
O3	1.445	-0.499	-0.190
F4	-1.349	-0.595	0.156
H5	1.170	1.480	-0.035
H6	0.629	0.570	1.367
H7	-1.291	1.399	0.064
H8	-0.701	0.520	-1.360
H9	1.022	-1.310	0.060

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5022	1.3971	2.3403	1.0829	1.0873	2.1468	2.1437	1.9231
C2	1.5022		2.4031	1.3755	2.1191	2.1261	1.0832	1.0823	2.5660
O3	1.3971	2.4031		2.8172	2.0039	2.0576	3.3395	2.6483	0.9482
F4	2.3403	1.3755	2.8172		3.2694	2.5961	1.9970	1.9906	2.4784
H5	1.0829	2.1191	2.0039	3.2694		1.7570	2.4643	2.4855	2.7955
H6	1.0873	2.1261	2.0576	2.5961	1.7570		2.4638	3.0350	2.3238
H7	2.1468	1.0832	3.3395	1.9970	2.4643	2.4638		1.7750	3.5619
H8	2.1437	1.0823	2.6483	1.9906	2.4855	3.0350	1.7750		2.8866
H9	1.9231	2.5660	0.9482	2.4784	2.7955	2.3238	3.5619	2.8866

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.746	C1	C2	H7	111.234
C1	C2	H8	111.034	C1	O3	H9	108.652
C2	C1	O3	111.913	C2	C1	H5	109.034
C2	C1	H6	109.333	O3	C1	H5	107.120
O3	C1	H6	111.218

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

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

States and conformations

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