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	hartrees
Energy at 0K	-214.550852
Energy at 298.15K
HF Energy	-213.920404
Nuclear repulsion energy	79.627343

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3898	3686	39.93
2	A	3166	2994	40.08
3	A	3079	2911	57.07
4	A	1573	1487	1.84
5	A	1504	1422	44.41
6	A	1442	1364	22.13
7	A	1311	1240	7.54
8	A	1183	1118	149.38
9	A	1125	1064	124.73
10	A	1078	1019	54.55
11	A	555	525	30.19
12	A	383	362	112.54

Atom	x (Å)	y (Å)	z (Å)
C1	0.025	0.505	0.047
F2	1.120	-0.311	-0.027
O3	-1.140	-0.212	-0.117
H4	0.070	1.017	1.015
H5	0.073	1.224	-0.772
H6	-1.255	-0.771	0.653

	C1	F2	O3	H4	H5	H6
C1		1.3674	1.3778	1.0956	1.0907	1.9065
F2	1.3674		2.2631	1.9877	2.0021	2.5121
O3	1.3778	2.2631		2.0629	1.9899	0.9590
H4	1.0956	1.9877	2.0629		1.7986	2.2548
H5	1.0907	2.0021	1.9899	1.7986		2.7880
H6	1.9065	2.5121	0.9590	2.2548	2.7880

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	108.006	F2	C1	O3	111.058
F2	C1	H4	107.097	F2	C1	H5	108.554
O3	C1	H4	112.536	O3	C1	H5	106.863
H4	C1	H5	110.701

All results from a given calculation for CH₂FOH (fluoromethanol)

using model chemistry: CCSD/6-31G(2df,p)

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: CCSD/6-31G(2df,p)

States and conformations

All results from a given calculation for CH₂FOH (fluoromethanol)