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	hartrees
Energy at 0K	-214.556687
Energy at 298.15K
HF Energy	-213.992459
Nuclear repulsion energy	79.508772

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3927	3672	43.39
2	A	3210	3002	34.53
3	A	3115	2913	60.96
4	A	1584	1481	5.23
5	A	1520	1421	51.26
6	A	1444	1350	15.68
7	A	1315	1230	7.06
8	A	1185	1108	144.64
9	A	1123	1050	133.31
10	A	1073	1004	109.63
11	A	570	533	42.02
12	A	394	368	128.45

Atom	x (Å)	y (Å)	z (Å)
C1	0.019	0.511	0.048
F2	1.122	-0.311	-0.028
O3	-1.140	-0.212	-0.115
H4	0.072	1.007	1.019
H5	0.074	1.226	-0.767
H6	-1.235	-0.801	0.636

	C1	F2	O3	H4	H5	H6
C1		1.3776	1.3763	1.0913	1.0860	1.9077
F2	1.3776		2.2660	1.9845	2.0021	2.4971
O3	1.3763	2.2660		2.0598	1.9916	0.9589
H4	1.0913	1.9845	2.0598		1.7993	2.2638
H5	1.0860	2.0021	1.9916	1.7993		2.7908
H6	1.9077	2.4971	0.9589	2.2638	2.7908

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	108.223	F2	C1	O3	110.733
F2	C1	H4	106.413	F2	C1	H5	108.136
O3	C1	H4	112.661	O3	C1	H5	107.381
H4	C1	H5	111.462

All results from a given calculation for CH₂FOH (fluoromethanol)

using model chemistry: MP3/TZVP

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/TZVP

States and conformations

All results from a given calculation for CH₂FOH (fluoromethanol)