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	hartrees
Energy at 0K	-253.984099
Energy at 298.15K
HF Energy	-253.029956
Nuclear repulsion energy	131.508865

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3907	3907	44.54
2	A	3154	3154	27.61
3	A	3131	3131	25.59
4	A	3092	3092	22.05
5	A	3055	3055	34.98
6	A	1530	1530	3.34
7	A	1525	1525	4.39
8	A	1468	1468	24.76
9	A	1432	1432	20.33
10	A	1410	1410	3.30
11	A	1302	1302	8.43
12	A	1248	1248	13.93
13	A	1164	1164	45.44
14	A	1142	1142	50.92
15	A	1094	1094	74.95
16	A	921	921	13.20
17	A	889	889	31.28
18	A	528	528	11.14
19	A	380	380	93.79
20	A	318	318	37.52
21	A	162	162	10.95

Atom	x (Å)	y (Å)	z (Å)
C1	0.678	0.573	0.284
C2	-0.717	0.552	-0.281
O3	1.450	-0.504	-0.190
F4	-1.353	-0.599	0.157
H5	1.178	1.487	-0.034
H6	0.627	0.573	1.376
H7	-1.297	1.408	0.061
H8	-0.698	0.522	-1.369
H9	1.007	-1.315	0.058

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5051	1.4069	2.3482	1.0893	1.0937	2.1557	2.1510	1.9297
C2	1.5051		2.4119	1.3857	2.1276	2.1337	1.0897	1.0887	2.5639
O3	1.4069	2.4119		2.8260	2.0154	2.0717	3.3561	2.6557	0.9572
F4	2.3482	1.3857	2.8260		3.2853	2.6040	2.0102	2.0036	2.4687
H5	1.0893	2.1276	2.0154	3.2853		1.7679	2.4777	2.4967	2.8090
H6	1.0937	2.1337	2.0717	2.6040	1.7679		2.4750	3.0486	2.3344
H7	2.1557	1.0897	3.3561	2.0102	2.4777	2.4750		1.7866	3.5674
H8	2.1510	1.0887	2.6557	2.0036	2.4967	3.0486	1.7866		2.8842
H9	1.9297	2.5639	0.9572	2.4687	2.8090	2.3344	3.5674	2.8842

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.574	C1	C2	H7	111.354
C1	C2	H8	111.032	C1	O3	H9	107.913
C2	C1	O3	111.801	C2	C1	H5	109.139
C2	C1	H6	109.357	O3	C1	H5	107.000
O3	C1	H6	111.268

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

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

States and conformations

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