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	hartrees
Energy at 0K	-214.511353
Energy at 298.15K
HF Energy	-213.940209
Nuclear repulsion energy	78.644834

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3855	3855	48.43
2	A	3173	3173	26.43
3	A	3083	3083	49.64
4	A	1530	1530	2.29
5	A	1453	1453	38.61
6	A	1411	1411	14.13
7	A	1272	1272	6.78
8	A	1156	1156	152.97
9	A	1080	1080	99.66
10	A	1028	1028	122.33
11	A	540	540	29.26
12	A	376	376	111.97

Atom	x (Å)	y (Å)	z (Å)
C1	0.015	0.516	0.048
F2	1.138	-0.313	-0.026
O3	-1.149	-0.219	-0.119
H4	0.068	1.019	1.027
H5	0.073	1.231	-0.783
H6	-1.276	-0.778	0.657

	C1	F2	O3	H4	H5	H6
C1		1.3981	1.3864	1.1025	1.0981	1.9261
F2	1.3981		2.2912	2.0071	2.0229	2.5514
O3	1.3864	2.2912		2.0801	2.0098	0.9644
H4	1.1025	2.0071	2.0801		1.8231	2.2739
H5	1.0981	2.0229	2.0098	1.8231		2.8162
H6	1.9261	2.5514	0.9644	2.2739	2.8162

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	108.711	F2	C1	O3	110.742
F2	C1	H4	106.160	F2	C1	H5	107.663
O3	C1	H4	112.895	O3	C1	H5	107.419
H4	C1	H5	111.874

All results from a given calculation for CH₂FOH (fluoromethanol)

using model chemistry: CCD/daug-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: CCD/daug-cc-pVDZ

States and conformations

All results from a given calculation for CH₂FOH (fluoromethanol)