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	hartrees
Energy at 0K	-253.634574
Energy at 298.15K
HF Energy	-252.946869
Nuclear repulsion energy	130.938486

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3868	3700	35.83
2	A	3154	3017	44.89
3	A	3134	2998	34.73
4	A	3088	2954	27.72
5	A	3042	2910	48.24
6	A	1510	1445	2.65
7	A	1505	1440	3.27
8	A	1472	1408	47.29
9	A	1434	1372	23.99
10	A	1407	1346	1.74
11	A	1285	1230	8.02
12	A	1246	1192	10.61
13	A	1163	1113	56.07
14	A	1139	1089	32.33
15	A	1098	1051	55.86
16	A	920	880	15.44
17	A	889	850	31.73
18	A	527	504	8.63
19	A	434	415	122.76
20	A	321	307	13.12
21	A	166	159	10.46

Atom	x (Å)	y (Å)	z (Å)
C1	0.692	0.582	0.278
C2	-0.721	0.565	-0.276
O3	1.436	-0.525	-0.189
F4	-1.341	-0.606	0.159
H5	1.210	1.496	-0.063
H6	0.644	0.610	1.386
H7	-1.312	1.428	0.079
H8	-0.706	0.549	-1.380
H9	0.918	-1.304	0.052

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5178	1.4132	2.3571	1.1041	1.1101	2.1841	2.1688	1.9130
C2	1.5178		2.4185	1.3941	2.1544	2.1522	1.1049	1.1043	2.5077
O3	1.4132	2.4185		2.7995	2.0370	2.0968	3.3821	2.6762	0.9661
F4	2.3571	1.3941	2.7995		3.3122	2.6318	2.0361	2.0263	2.3665
H5	1.1041	2.1544	2.0370	3.3122		1.7901	2.5267	2.5104	2.8171
H6	1.1101	2.1522	2.0968	2.6318	1.7901		2.4912	3.0794	2.3493
H7	2.1841	1.1049	3.3821	2.0361	2.5267	2.4912		1.8082	3.5271
H8	2.1688	1.1043	2.6762	2.0263	2.5104	3.0794	1.8082		2.8504
H9	1.9130	2.5077	0.9661	2.3665	2.8171	2.3493	3.5271	2.8504

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.012	C1	C2	H7	111.800
C1	C2	H8	110.620	C1	O3	H9	105.488
C2	C1	O3	111.158	C2	C1	H5	109.497
C2	C1	H6	108.973	O3	C1	H5	107.401
O3	C1	H6	111.833

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

using model chemistry: CCD/cc-pVDZ

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: CCD/cc-pVDZ

States and conformations

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