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	hartrees
Energy at 0K	-214.801308
Energy at 298.15K
HF Energy	-214.631414
Nuclear repulsion energy	78.728033

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	3849	3849	50.60	69.49	0.22	0.37
2	A	3209	3209	27.84	64.15	0.55	0.71
3	A	3104	3104	56.11	101.44	0.13	0.23
4	A	1558	1558	3.23	6.93	0.74	0.85
5	A	1460	1460	38.63	5.45	0.75	0.86
6	A	1398	1398	13.67	4.47	0.73	0.84
7	A	1268	1268	7.13	5.47	0.67	0.80
8	A	1153	1153	151.72	4.73	0.16	0.28
9	A	1073	1073	100.66	1.04	0.45	0.62
10	A	986	986	182.51	5.28	0.37	0.54
11	A	538	538	44.06	1.44	0.55	0.71
12	A	399	399	134.88	2.26	0.75	0.85

Atom	x (Å)	y (Å)	z (Å)
C1	0.009	0.517	0.049
F2	1.141	-0.310	-0.027
O3	-1.147	-0.218	-0.117
H4	0.067	1.009	1.022
H5	0.065	1.223	-0.775
H6	-1.272	-0.798	0.645

	C1	F2	O3	H4	H5	H6
C1		1.4045	1.3798	1.0921	1.0868	1.9296
F2	1.4045		2.2920	1.9985	2.0173	2.5517
O3	1.3798	2.2920		2.0686	1.9951	0.9656
H4	1.0921	1.9985	2.0686		1.8099	2.2804
H5	1.0868	2.0173	1.9951	1.8099		2.8086
H6	1.9296	2.5517	0.9656	2.2804	2.8086

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	109.445	F2	C1	O3	110.809
F2	C1	H4	105.672	F2	C1	H5	107.461
O3	C1	H4	113.095	O3	C1	H5	107.369
H4	C1	H5	112.331

All results from a given calculation for CH₂FOH (fluoromethanol)

using model chemistry: B2PLYP=FULLultrafine/6-31+G**

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 CH2FOH (fluoromethanol)

using model chemistry: B2PLYP=FULLultrafine/6-31+G**

States and conformations

All results from a given calculation for CH₂FOH (fluoromethanol)