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	hartrees
Energy at 0K	-214.414002
Energy at 298.15K
HF Energy	-213.907515
Nuclear repulsion energy	79.048420

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	3895	3640	39.84	65.19	0.29	0.45
2	A	3241	3029	47.88	59.33	0.52	0.68
3	A	3132	2927	69.61	88.44	0.14	0.24
4	A	1605	1500	4.53	9.13	0.73	0.84
5	A	1509	1410	55.34	6.48	0.75	0.86
6	A	1429	1335	18.90	6.81	0.75	0.86
7	A	1302	1216	6.52	8.08	0.72	0.84
8	A	1178	1101	146.53	3.71	0.31	0.47
9	A	1111	1038	135.91	3.02	0.35	0.51
10	A	1062	993	81.22	2.81	0.46	0.63
11	A	551	514	47.05	1.89	0.63	0.77
12	A	397	371	122.54	4.61	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.016	0.510	0.049
F2	1.134	-0.309	-0.029
O3	-1.149	-0.214	-0.116
H4	0.066	1.013	1.016
H5	0.058	1.225	-0.767
H6	-1.241	-0.804	0.641

	C1	F2	O3	H4	H5	H6
C1		1.3883	1.3820	1.0912	1.0854	1.9137
F2	1.3883		2.2868	1.9951	2.0146	2.5176
O3	1.3820	2.2868		2.0645	1.9881	0.9643
H4	1.0912	1.9951	2.0645		1.7958	2.2698
H5	1.0854	2.0146	1.9881	1.7958		2.7913
H6	1.9137	2.5176	0.9643	2.2698	2.7913

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	107.974	F2	C1	O3	111.276
F2	C1	H4	106.530	F2	C1	H5	108.434
O3	C1	H4	112.649	O3	C1	H5	106.749
H4	C1	H5	111.180

All results from a given calculation for CH₂FOH (fluoromethanol)

using model chemistry: MP2=FULL/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 CH2FOH (fluoromethanol)

using model chemistry: MP2=FULL/6-31G**

States and conformations

All results from a given calculation for CH₂FOH (fluoromethanol)