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	hartrees
Energy at 0K	-253.765508
Energy at 298.15K
HF Energy	-253.030772
Nuclear repulsion energy	130.780918

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3873	3696	34.40
2	A	3162	3018	34.50
3	A	3140	2996	29.06
4	A	3098	2957	24.03
5	A	3059	2920	39.24
6	A	1533	1463	3.54
7	A	1525	1455	4.15
8	A	1482	1414	29.41
9	A	1447	1381	24.49
10	A	1420	1356	2.70
11	A	1304	1244	6.09
12	A	1249	1192	15.79
13	A	1160	1107	9.72
14	A	1135	1083	77.20
15	A	1085	1035	64.31
16	A	917	875	16.39
17	A	884	844	39.04
18	A	526	502	13.99
19	A	420	401	124.54
20	A	322	307	22.08
21	A	155	148	10.81

Atom	x (Å)	y (Å)	z (Å)
C1	0.682	0.574	0.286
C2	-0.717	0.555	-0.283
O3	1.463	-0.508	-0.189
F4	-1.367	-0.599	0.157
H5	1.182	1.489	-0.035
H6	0.626	0.576	1.380
H7	-1.295	1.416	0.058
H8	-0.695	0.521	-1.373
H9	0.998	-1.314	0.054

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5104	1.4164	2.3648	1.0911	1.0959	2.1604	2.1560	1.9283
C2	1.5104		2.4277	1.3961	2.1312	2.1379	1.0916	1.0906	2.5594
O3	1.4164	2.4277		2.8529	2.0228	2.0825	3.3719	2.6679	0.9620
F4	2.3648	1.3961	2.8529		3.3013	2.6172	2.0197	2.0122	2.4729
H5	1.0911	2.1312	2.0228	3.3013		1.7735	2.4794	2.5000	2.8109
H6	1.0959	2.1379	2.0825	2.6172	1.7735		2.4782	3.0538	2.3383
H7	2.1604	1.0916	3.3719	2.0197	2.4794	2.4782		1.7917	3.5654
H8	2.1560	1.0906	2.6679	2.0122	2.5000	3.0538	1.7917		2.8759
H9	1.9283	2.5594	0.9620	2.4729	2.8109	2.3383	3.5654	2.8759

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	108.837	C1	C2	H7	111.235
C1	C2	H8	110.938	C1	O3	H9	106.782
C2	C1	O3	112.047	C2	C1	H5	108.942
C2	C1	H6	109.191	O3	C1	H5	106.832
O3	C1	H6	111.338

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

using model chemistry: CCSD/TZVP

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: CCSD/TZVP

States and conformations

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