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	hartrees
Energy at 0K	-251.931814
Energy at 298.15K
HF Energy	-251.538460
Nuclear repulsion energy	130.314063

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3644	3391	8.53
2	A	3215	2991	38.42
3	A	3206	2983	19.62
4	A	3160	2940	19.98
5	A	3110	2894	35.66
6	A	1627	1514	1.54
7	A	1619	1507	0.82
8	A	1499	1394	6.02
9	A	1484	1381	37.67
10	A	1463	1362	17.93
11	A	1318	1226	9.19
12	A	1288	1198	17.31
13	A	1178	1096	2.95
14	A	1109	1032	39.99
15	A	1065	991	46.22
16	A	931	866	10.31
17	A	904	841	29.46
18	A	526	489	6.93
19	A	491	457	188.62
20	A	314	293	3.19
21	A	174	162	15.34

Atom	x (Å)	y (Å)	z (Å)
C1	0.694	0.623	0.280
C2	-0.723	0.601	-0.280
O3	1.397	-0.562	-0.188
F4	-1.297	-0.634	0.165
H5	1.243	1.487	-0.087
H6	0.649	0.664	1.373
H7	-1.328	1.431	0.080
H8	-0.697	0.593	-1.368
H9	0.805	-1.321	0.019

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5230	1.4555	2.3570	1.0878	1.0943	2.1861	2.1568	1.9647
C2	1.5230		2.4197	1.4328	2.1645	2.1487	1.0887	1.0885	2.4736
O3	1.4555	2.4197		2.7183	2.0573	2.1207	3.3869	2.6674	0.9846
F4	2.3570	1.4328	2.7183		3.3186	2.6325	2.0670	2.0533	2.2166
H5	1.0878	2.1645	2.0573	3.3186		1.7782	2.5768	2.4907	2.8440
H6	1.0943	2.1487	2.1207	2.6325	1.7782		2.4834	3.0546	2.4075
H7	2.1861	1.0887	3.3869	2.0670	2.5768	2.4834		1.7884	3.4827
H8	2.1568	1.0885	2.6674	2.0533	2.4907	3.0546	1.7884		2.8012
H9	1.9647	2.4736	0.9846	2.2166	2.8440	2.4075	3.4827	2.8012

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	105.724	C1	C2	H7	112.594
C1	C2	H8	110.248	C1	O3	H9	105.630
C2	C1	O3	108.641	C2	C1	H5	110.902
C2	C1	H6	109.266	O3	C1	H5	107.099
O3	C1	H6	111.769

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

using model chemistry: CID/3-21G*

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: CID/3-21G*

States and conformations

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