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	hartrees
Energy at 0K	-253.576314
Energy at 298.15K
HF Energy	-252.936473
Nuclear repulsion energy	131.430451

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	3877	3631	34.79	46.79	0.24	0.39
2	A	3222	3017	39.50	46.18	0.73	0.85
3	A	3200	2997	26.13	71.24	0.47	0.64
4	A	3146	2947	28.22	96.31	0.13	0.23
5	A	3105	2908	42.44	94.16	0.17	0.30
6	A	1568	1468	1.58	5.65	0.74	0.85
7	A	1559	1460	1.18	12.55	0.74	0.85
8	A	1481	1387	31.03	4.10	0.60	0.75
9	A	1449	1357	29.29	2.55	0.72	0.83
10	A	1419	1329	8.69	11.02	0.75	0.86
11	A	1297	1214	7.87	10.34	0.71	0.83
12	A	1256	1176	14.68	6.83	0.75	0.86
13	A	1170	1096	3.58	2.28	0.29	0.45
14	A	1136	1063	82.46	5.19	0.72	0.83
15	A	1088	1019	55.70	1.71	0.63	0.78
16	A	931	872	16.74	6.70	0.30	0.46
17	A	899	842	32.93	4.06	0.43	0.60
18	A	535	501	11.65	1.01	0.74	0.85
19	A	450	421	138.77	2.93	0.74	0.85
20	A	329	308	11.45	0.25	0.57	0.72
21	A	173	162	12.02	0.03	0.35	0.51

Atom	x (Å)	y (Å)	z (Å)
C1	0.687	0.590	0.278
C2	-0.714	0.577	-0.277
O3	1.418	-0.533	-0.187
F4	-1.323	-0.612	0.159
H5	1.217	1.480	-0.061
H6	0.639	0.615	1.372
H7	-1.308	1.419	0.079
H8	-0.700	0.562	-1.366
H9	0.876	-1.301	0.035

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5074	1.4186	2.3450	1.0896	1.0952	2.1703	2.1511	1.9162
C2	1.5074		2.4057	1.4049	2.1428	2.1338	1.0905	1.0893	2.4809
O3	1.4186	2.4057		2.7640	2.0270	2.0873	3.3641	2.6597	0.9660
F4	2.3450	1.4049	2.7640		3.2976	2.6129	2.0328	2.0234	2.3081
H5	1.0896	2.1428	2.0270	3.2976		1.7702	2.5299	2.4937	2.8036
H6	1.0952	2.1338	2.0873	2.6129	1.7702		2.4726	3.0484	2.3486
H7	2.1703	1.0905	3.3641	2.0328	2.5299	2.4726		1.7866	3.4895
H8	2.1511	1.0893	2.6597	2.0234	2.4937	3.0484	1.7866		2.8144
H9	1.9162	2.4809	0.9660	2.3081	2.8036	2.3486	3.4895	2.8144

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	107.207	C1	C2	H7	112.320
C1	C2	H8	110.837	C1	O3	H9	105.364
C2	C1	O3	110.566	C2	C1	H5	110.158
C2	C1	H6	109.114	O3	C1	H5	107.100
O3	C1	H6	111.616

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)