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	hartrees
Energy at 0K	-253.767548
Energy at 298.15K
HF Energy	-253.030657
Nuclear repulsion energy	130.714702

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3867	3694	33.93
2	A	3160	3018	34.71
3	A	3137	2997	29.26
4	A	3095	2957	24.59
5	A	3056	2919	39.76
6	A	1531	1463	3.48
7	A	1523	1455	4.04
8	A	1479	1413	29.66
9	A	1445	1380	24.02
10	A	1418	1355	2.67
11	A	1301	1243	6.00
12	A	1247	1191	15.76
13	A	1158	1106	6.95
14	A	1131	1081	79.42
15	A	1078	1030	62.81
16	A	915	874	16.72
17	A	881	842	40.01
18	A	525	502	14.00
19	A	421	402	124.49
20	A	321	307	21.40
21	A	155	148	10.79

Atom	x (Å)	y (Å)	z (Å)
C1	0.682	0.574	0.286
C2	-0.717	0.556	-0.283
O3	1.463	-0.509	-0.189
F4	-1.368	-0.600	0.157
H5	1.184	1.489	-0.035
H6	0.626	0.576	1.380
H7	-1.295	1.417	0.059
H8	-0.695	0.522	-1.373
H9	0.996	-1.315	0.053

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5106	1.4173	2.3660	1.0913	1.0961	2.1612	2.1566	1.9287
C2	1.5106		2.4285	1.3981	2.1316	2.1383	1.0918	1.0908	2.5587
O3	1.4173	2.4285		2.8535	2.0235	2.0834	3.3732	2.6687	0.9623
F4	2.3660	1.3981	2.8535		3.3031	2.6181	2.0210	2.0135	2.4713
H5	1.0913	2.1316	2.0235	3.3031		1.7742	2.4811	2.5010	2.8113
H6	1.0961	2.1383	2.0834	2.6181	1.7742		2.4788	3.0546	2.3390
H7	2.1612	1.0918	3.3732	2.0210	2.4811	2.4788		1.7926	3.5650
H8	2.1566	1.0908	2.6687	2.0135	2.5010	3.0546	1.7926		2.8749
H9	1.9287	2.5587	0.9623	2.4713	2.8113	2.3390	3.5650	2.8749

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.801	C1	C2	H7	111.268
C1	C2	H8	110.964	C1	O3	H9	106.720
C2	C1	O3	112.034	C2	C1	H5	108.952
C2	C1	H6	109.195	O3	C1	H5	106.811
O3	C1	H6	111.331

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

using model chemistry: QCISD/TZVP

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/TZVP

States and conformations

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