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	hartrees
Energy at 0K	-253.956253
Energy at 298.15K
HF Energy	-253.045155
Nuclear repulsion energy	131.353899

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A	3850	3850	48.80	48.79	0.18	0.30
2	A	3176	3176	24.78	43.63	0.74	0.85
3	A	3153	3153	19.81	74.21	0.40	0.58
4	A	3106	3106	23.28	117.18	0.10	0.18
5	A	3071	3071	34.06	120.28	0.12	0.22
6	A	1520	1520	3.39	3.17	0.75	0.86
7	A	1509	1509	3.43	6.60	0.74	0.85
8	A	1451	1451	20.22	2.58	0.24	0.38
9	A	1421	1421	21.35	1.46	0.73	0.85
10	A	1399	1399	3.40	6.04	0.73	0.85
11	A	1293	1293	7.80	5.60	0.68	0.81
12	A	1243	1243	12.70	3.53	0.74	0.85
13	A	1146	1146	22.00	3.11	0.25	0.39
14	A	1132	1132	70.17	2.56	0.75	0.86
15	A	1075	1075	71.88	2.33	0.62	0.77
16	A	914	914	15.31	4.86	0.27	0.43
17	A	881	881	32.86	3.89	0.32	0.48
18	A	523	523	10.34	0.81	0.74	0.85
19	A	390	390	101.20	1.19	0.71	0.83
20	A	320	320	27.72	0.34	0.56	0.71
21	A	156	156	11.45	0.06	0.60	0.75

Atom	x (Å)	y (Å)	z (Å)
C1	0.678	0.575	0.284
C2	-0.713	0.556	-0.282
O3	1.451	-0.510	-0.188
F4	-1.356	-0.600	0.157
H5	1.180	1.483	-0.036
H6	0.624	0.580	1.374
H7	-1.290	1.412	0.057
H8	-0.689	0.524	-1.367
H9	0.977	-1.312	0.049

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5018	1.4135	2.3515	1.0861	1.0907	2.1507	2.1443	1.9247
C2	1.5018		2.4145	1.3933	2.1223	2.1282	1.0866	1.0856	2.5407
O3	1.4135	2.4145		2.8293	2.0166	2.0762	3.3570	2.6538	0.9608
F4	2.3515	1.3933	2.8293		3.2870	2.6056	2.0151	2.0075	2.4415
H5	1.0861	2.1223	2.0166	3.2870		1.7642	2.4735	2.4869	2.8030
H6	1.0907	2.1282	2.0762	2.6056	1.7642		2.4676	3.0395	2.3367
H7	2.1507	1.0866	3.3570	2.0151	2.4735	2.4676		1.7823	3.5440
H8	2.1443	1.0856	2.6538	2.0075	2.4869	3.0395	1.7823		2.8552
H9	1.9247	2.5407	0.9608	2.4415	2.8030	2.3367	3.5440	2.8552

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.571	C1	C2	H7	111.372
C1	C2	H8	110.919	C1	O3	H9	106.759
C2	C1	O3	111.796	C2	C1	H5	109.130
C2	C1	H6	109.329	O3	C1	H5	106.831
O3	C1	H6	111.362

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

using model chemistry: MP2=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: MP2=FULL/Def2TZVPP

States and conformations

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