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	hartrees
Energy at 0K	-254.014646
Energy at 298.15K
HF Energy	-253.044944
Nuclear repulsion energy	131.107820

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3836	3836
2	A	3124	3124
3	A	3104	3104
4	A	3063	3063
5	A	3026	3026
6	A	1509	1509
7	A	1500	1500
8	A	1447	1447
9	A	1417	1417
10	A	1396	1396
11	A	1284	1284
12	A	1236	1236
13	A	1139	1139
14	A	1122	1122
15	A	1068	1068
16	A	905	905
17	A	874	874
18	A	520	520
19	A	389	389
20	A	316	316
21	A	152	152

Atom	x (Å)	y (Å)	z (Å)
C1	0.681	0.578	0.283
C2	-0.717	0.558	-0.282
O3	1.451	-0.513	-0.188
F4	-1.355	-0.602	0.158
H5	1.185	1.487	-0.042
H6	0.630	0.586	1.376
H7	-1.297	1.413	0.063
H8	-0.697	0.529	-1.370
H9	0.974	-1.312	0.050

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5080	1.4161	2.3564	1.0891	1.0937	2.1587	2.1525	1.9266
C2	1.5080		2.4201	1.3947	2.1304	2.1357	1.0895	1.0886	2.5429
O3	1.4161	2.4201		2.8285	2.0223	2.0802	3.3656	2.6637	0.9608
F4	2.3564	1.3947	2.8285		3.2946	2.6139	2.0183	2.0109	2.4369
H5	1.0891	2.1304	2.0223	3.2946		1.7698	2.4860	2.4943	2.8081
H6	1.0937	2.1357	2.0802	2.6139	1.7698		2.4742	3.0496	2.3400
H7	2.1587	1.0895	3.3656	2.0183	2.4860	2.4742		1.7876	3.5477
H8	2.1525	1.0886	2.6637	2.0109	2.4943	3.0496	1.7876		2.8630
H9	1.9266	2.5429	0.9608	2.4369	2.8081	2.3400	3.5477	2.8630

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.479	C1	C2	H7	111.402
C1	C2	H8	110.954	C1	O3	H9	106.733
C2	C1	O3	111.674	C2	C1	H5	109.165
C2	C1	H6	109.312	O3	C1	H5	106.934
O3	C1	H6	111.309

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

using model chemistry: QCISD(T)=FULL/Def2TZVPP

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(T)=FULL/Def2TZVPP

States and conformations

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