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	hartrees
Energy at 0K	-214.502027
Energy at 298.15K
HF Energy	-213.938470
Nuclear repulsion energy	78.397033

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	3822	3704	53.85	68.06	0.16	0.28
2	A	3217	3118	22.69	52.74	0.54	0.70
3	A	3114	3018	47.90	109.89	0.08	0.15
4	A	1527	1480	2.19	3.41	0.75	0.86
5	A	1440	1396	27.21	1.42	0.72	0.84
6	A	1394	1351	13.44	2.33	0.55	0.71
7	A	1260	1221	7.09	2.93	0.56	0.72
8	A	1140	1105	141.21	5.51	0.11	0.19
9	A	1068	1035	89.35	0.80	0.22	0.36
10	A	988	957	160.52	5.41	0.38	0.55
11	A	530	513	30.25	1.25	0.46	0.63
12	A	388	377	110.54	1.81	0.71	0.83

Atom	x (Å)	y (Å)	z (Å)
C1	0.009	0.518	0.048
F2	1.146	-0.311	-0.026
O3	-1.152	-0.222	-0.120
H4	0.065	1.018	1.026
H5	0.066	1.225	-0.787
H6	-1.282	-0.770	0.667

	C1	F2	O3	H4	H5	H6
C1		1.4089	1.3870	1.0999	1.0953	1.9260
F2	1.4089		2.3009	2.0103	2.0264	2.5654
O3	1.3870	2.3009		2.0809	2.0060	0.9672
H4	1.0999	2.0103	2.0809		1.8245	2.2669
H5	1.0953	2.0264	2.0060	1.8245		2.8128
H6	1.9260	2.5654	0.9672	2.2669	2.8128

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	108.470	F2	C1	O3	110.756
F2	C1	H4	105.848	F2	C1	H5	107.373
O3	C1	H4	113.083	O3	C1	H5	107.241
H4	C1	H5	112.433

All results from a given calculation for CH₂FOH (fluoromethanol)

using model chemistry: MP2=FULL/aug-cc-pVDZ

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/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₂FOH (fluoromethanol)