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	hartrees
Energy at 0K	-253.897444
Energy at 298.15K
HF Energy	-253.032414
Nuclear repulsion energy	131.250864

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3876	3703	38.66
2	A	3141	3001	34.03
3	A	3119	2980	28.87
4	A	3080	2943	24.47
5	A	3043	2907	38.17
6	A	1524	1456	2.85
7	A	1517	1449	2.89
8	A	1463	1398	28.84
9	A	1432	1368	23.24
10	A	1410	1347	2.73
11	A	1294	1237	8.25
12	A	1247	1191	13.34
13	A	1156	1104	31.93
14	A	1137	1086	58.59
15	A	1087	1038	67.29
16	A	915	875	13.98
17	A	884	845	32.15
18	A	525	502	10.51
19	A	392	375	102.75
20	A	317	303	25.00
21	A	156	149	11.16

Atom	x (Å)	y (Å)	z (Å)
C1	0.681	0.576	0.282
C2	-0.718	0.555	-0.281
O3	1.451	-0.511	-0.188
F4	-1.353	-0.601	0.157
H5	1.184	1.487	-0.043
H6	0.631	0.587	1.376
H7	-1.298	1.412	0.064
H8	-0.699	0.529	-1.370
H9	0.979	-1.311	0.052

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5080	1.4128	2.3535	1.0900	1.0945	2.1592	2.1527	1.9247
C2	1.5080		2.4184	1.3901	2.1311	2.1361	1.0904	1.0895	2.5444
O3	1.4128	2.4184		2.8265	2.0208	2.0791	3.3640	2.6637	0.9595
F4	2.3535	1.3901	2.8265		3.2918	2.6133	2.0164	2.0090	2.4401
H5	1.0900	2.1311	2.0208	3.2918		1.7690	2.4850	2.4944	2.8072
H6	1.0945	2.1361	2.0791	2.6133	1.7690		2.4745	3.0506	2.3397
H7	2.1592	1.0904	3.3640	2.0164	2.4850	2.4745		1.7871	3.5499
H8	2.1527	1.0895	2.6637	2.0090	2.4944	3.0506	1.7871		2.8669
H9	1.9247	2.5444	0.9595	2.4401	2.8072	2.3397	3.5499	2.8669

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.529	C1	C2	H7	111.380
C1	C2	H8	110.909	C1	O3	H9	106.889
C2	C1	O3	111.741	C2	C1	H5	109.164
C2	C1	H6	109.292	O3	C1	H5	106.983
O3	C1	H6	111.398

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

using model chemistry: QCISD/cc-pVTZ

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: QCISD/cc-pVTZ

States and conformations

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