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	hartrees
Energy at 0K	-253.759552
Energy at 298.15K
HF Energy	-253.031001
Nuclear repulsion energy	130.884075

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3895	3693	36.69
2	A	3170	3005	34.14
3	A	3149	2985	28.19
4	A	3106	2944	23.92
5	A	3068	2908	38.28
6	A	1538	1458	3.73
7	A	1529	1449	4.48
8	A	1487	1410	28.92
9	A	1452	1376	25.06
10	A	1425	1351	3.09
11	A	1310	1242	6.32
12	A	1253	1188	16.02
13	A	1166	1105	19.54
14	A	1143	1084	68.48
15	A	1097	1039	66.94
16	A	921	873	15.60
17	A	889	843	37.37
18	A	528	501	13.84
19	A	417	396	124.62
20	A	322	305	23.95
21	A	155	147	10.84

Atom	x (Å)	y (Å)	z (Å)
C1	0.681	0.573	0.285
C2	-0.718	0.553	-0.283
O3	1.464	-0.506	-0.189
F4	-1.368	-0.598	0.157
H5	1.179	1.489	-0.034
H6	0.626	0.574	1.379
H7	-1.294	1.415	0.057
H8	-0.695	0.519	-1.372
H9	1.006	-1.314	0.056

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5102	1.4145	2.3633	1.0907	1.0954	2.1590	2.1550	1.9279
C2	1.5102		2.4269	1.3926	2.1302	2.1374	1.0913	1.0904	2.5632
O3	1.4145	2.4269		2.8540	2.0212	2.0804	3.3696	2.6668	0.9607
F4	2.3633	1.3926	2.8540		3.2983	2.6158	2.0171	2.0098	2.4809
H5	1.0907	2.1302	2.0212	3.2983		1.7721	2.4755	2.4987	2.8098
H6	1.0954	2.1374	2.0804	2.6158	1.7721		2.4776	3.0526	2.3363
H7	2.1590	1.0913	3.3696	2.0171	2.4755	2.4776		1.7901	3.5685
H8	2.1550	1.0904	2.6668	2.0098	2.4987	3.0526	1.7901		2.8800
H9	1.9279	2.5632	0.9607	2.4809	2.8098	2.3363	3.5685	2.8800

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.935	C1	C2	H7	111.161
C1	C2	H8	110.893	C1	O3	H9	106.963
C2	C1	O3	112.114	C2	C1	H5	108.910
C2	C1	H6	109.191	O3	C1	H5	106.858
O3	C1	H6	111.334

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

using model chemistry: CCD/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: CCD/TZVP

States and conformations

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