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	hartrees
Energy at 0K	-253.532634
Energy at 298.15K
HF Energy	-252.922909
Nuclear repulsion energy	131.187830

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	3764	3549	38.02	47.37	0.26	0.41
2	A	3200	3018	36.51	46.55	0.73	0.84
3	A	3180	2998	23.59	72.34	0.46	0.63
4	A	3128	2950	26.21	95.05	0.14	0.24
5	A	3085	2909	39.54	93.91	0.18	0.31
6	A	1572	1483	1.84	6.07	0.73	0.85
7	A	1563	1474	1.50	12.74	0.74	0.85
8	A	1479	1395	33.84	4.85	0.61	0.76
9	A	1450	1368	27.10	3.20	0.73	0.85
10	A	1422	1341	6.84	10.53	0.75	0.86
11	A	1296	1222	8.86	10.97	0.71	0.83
12	A	1257	1186	15.53	7.19	0.75	0.86
13	A	1170	1103	2.43	2.35	0.31	0.47
14	A	1134	1069	84.24	5.38	0.71	0.83
15	A	1086	1024	55.77	1.88	0.64	0.78
16	A	931	878	16.32	6.75	0.31	0.48
17	A	899	848	33.44	4.08	0.43	0.60
18	A	535	504	11.73	1.04	0.74	0.85
19	A	446	421	146.05	2.97	0.74	0.85
20	A	331	312	12.81	0.26	0.57	0.73
21	A	173	163	12.40	0.03	0.37	0.54

Atom	x (Å)	y (Å)	z (Å)
C1	0.686	0.590	0.281
C2	-0.714	0.577	-0.279
O3	1.421	-0.532	-0.189
F4	-1.325	-0.612	0.160
H5	1.222	1.482	-0.054
H6	0.637	0.608	1.379
H7	-1.315	1.421	0.074
H8	-0.698	0.557	-1.372
H9	0.881	-1.309	0.037

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5084	1.4210	2.3460	1.0932	1.0991	2.1764	2.1555	1.9250
C2	1.5084		2.4077	1.4073	2.1494	2.1389	1.0942	1.0928	2.4911
O3	1.4210	2.4077		2.7686	2.0285	2.0909	3.3714	2.6592	0.9733
F4	2.3460	1.4073	2.7686		3.3044	2.6118	2.0356	2.0267	2.3164
H5	1.0932	2.1494	2.0285	3.3044		1.7772	2.5406	2.5055	2.8140
H6	1.0991	2.1389	2.0909	2.6118	1.7772		2.4843	3.0573	2.3526
H7	2.1764	1.0942	3.3714	2.0356	2.5406	2.4843		1.7936	3.5042
H8	2.1555	1.0928	2.6592	2.0267	2.5055	3.0573	1.7936		2.8217
H9	1.9250	2.4911	0.9733	2.3164	2.8140	2.3526	3.5042	2.8217

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	107.094	C1	C2	H7	112.517
C1	C2	H8	110.914	C1	O3	H9	105.495
C2	C1	O3	110.516	C2	C1	H5	110.400
C2	C1	H6	109.228	O3	C1	H5	106.840
O3	C1	H6	111.492

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

using model chemistry: MP2/6-31G*

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: MP2/6-31G*

States and conformations

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