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	hartrees
Energy at 0K	-253.786535
Energy at 298.15K
HF Energy	-253.046253
Nuclear repulsion energy	132.083359

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	4044	4044	57.83
2	A	3243	3243	32.73
3	A	3219	3219	29.80
4	A	3182	3182	22.35
5	A	3144	3144	37.53
6	A	1576	1576	2.90
7	A	1568	1568	3.88
8	A	1519	1519	26.37
9	A	1480	1480	23.95
10	A	1453	1453	7.48
11	A	1343	1343	9.81
12	A	1285	1285	15.03
13	A	1204	1204	60.88
14	A	1177	1177	45.83
15	A	1132	1132	82.43
16	A	948	948	13.33
17	A	914	914	33.94
18	A	542	542	12.29
19	A	392	392	99.97
20	A	324	324	38.78
21	A	159	159	11.36

Atom	x (Å)	y (Å)	z (Å)
C1	0.677	0.569	0.281
C2	-0.716	0.547	-0.278
O3	1.447	-0.501	-0.188
F4	-1.352	-0.595	0.156
H5	1.169	1.479	-0.037
H6	0.629	0.574	1.366
H7	-1.288	1.400	0.063
H8	-0.699	0.522	-1.359
H9	1.014	-1.308	0.056

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5012	1.3993	2.3428	1.0818	1.0862	2.1446	2.1412	1.9203
C2	1.5012		2.4054	1.3774	2.1169	2.1241	1.0821	1.0812	2.5583
O3	1.3993	2.4054		2.8217	2.0047	2.0590	3.3403	2.6502	0.9482
F4	2.3428	1.3774	2.8217		3.2704	2.5990	1.9984	1.9917	2.4726
H5	1.0818	2.1169	2.0047	3.2704		1.7546	2.4607	2.4810	2.7926
H6	1.0862	2.1241	2.0590	2.5990	1.7546		2.4605	3.0316	2.3246
H7	2.1446	1.0821	3.3403	1.9984	2.4607	2.4605		1.7720	3.5540
H8	2.1412	1.0812	2.6502	1.9917	2.4810	3.0316	1.7720		2.8783
H9	1.9203	2.5583	0.9482	2.4726	2.7926	2.3246	3.5540	2.8783

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.872	C1	C2	H7	111.192
C1	C2	H8	110.974	C1	O3	H9	108.234
C2	C1	O3	112.008	C2	C1	H5	108.995
C2	C1	H6	109.310	O3	C1	H5	107.104
O3	C1	H6	111.246

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

using model chemistry: CISD/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: CISD/Def2TZVPP

States and conformations

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