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	hartrees
Energy at 0K	-214.515913
Energy at 298.15K
HF Energy	-213.940565
Nuclear repulsion energy	78.795734

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3882	3882	50.70
2	A	3193	3193	26.67
3	A	3103	3103	50.19
4	A	1536	1536	2.25
5	A	1460	1460	38.24
6	A	1416	1416	15.19
7	A	1279	1279	7.04
8	A	1164	1164	153.93
9	A	1085	1085	105.70
10	A	1036	1036	114.64
11	A	543	543	29.65
12	A	377	377	112.77

Atom	x (Å)	y (Å)	z (Å)
C1	0.015	0.515	0.047
F2	1.136	-0.313	-0.026
O3	-1.147	-0.218	-0.118
H4	0.068	1.018	1.025
H5	0.074	1.230	-0.781
H6	-1.274	-0.777	0.655

	C1	F2	O3	H4	H5	H6
C1		1.3949	1.3841	1.1006	1.0961	1.9230
F2	1.3949		2.2868	2.0035	2.0192	2.5462
O3	1.3841	2.2868		2.0765	2.0069	0.9624
H4	1.1006	2.0035	2.0765		1.8186	2.2710
H5	1.0961	2.0192	2.0069	1.8186		2.8116
H6	1.9230	2.5462	0.9624	2.2710	2.8116

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	108.737	F2	C1	O3	110.742
F2	C1	H4	106.205	F2	C1	H5	107.704
O3	C1	H4	112.887	O3	C1	H5	107.456
H4	C1	H5	111.760

All results from a given calculation for CH₂FOH (fluoromethanol)

using model chemistry: MP3=FULL/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: MP3=FULL/daug-cc-pVDZ

States and conformations

All results from a given calculation for CH₂FOH (fluoromethanol)