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	hartrees
Energy at 0K	-214.529980
Energy at 298.15K
HF Energy	-213.920160
Nuclear repulsion energy	79.513914

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	3882	3666	48.52	55.37	0.27	0.43
2	A	3191	3014	38.17	54.89	0.52	0.68
3	A	3094	2922	56.97	83.21	0.13	0.23
4	A	1570	1483	1.60	7.14	0.73	0.85
5	A	1496	1413	37.94	4.38	0.75	0.86
6	A	1428	1349	19.44	4.94	0.74	0.85
7	A	1305	1232	7.37	6.25	0.71	0.83
8	A	1172	1107	138.86	3.38	0.26	0.42
9	A	1113	1051	138.00	3.16	0.26	0.41
10	A	1068	1009	59.22	1.78	0.50	0.66
11	A	550	520	30.02	1.48	0.56	0.72
12	A	387	365	112.28	3.20	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.023	0.505	0.047
F2	1.123	-0.310	-0.027
O3	-1.142	-0.213	-0.118
H4	0.069	1.016	1.014
H5	0.068	1.221	-0.772
H6	-1.254	-0.770	0.658

	C1	F2	O3	H4	H5	H6
C1		1.3709	1.3784	1.0949	1.0898	1.9047
F2	1.3709		2.2692	1.9886	2.0039	2.5164
O3	1.3784	2.2692		2.0635	1.9873	0.9609
H4	1.0949	1.9886	2.0635		1.7985	2.2508
H5	1.0898	2.0039	1.9873	1.7985		2.7849
H6	1.9047	2.5164	0.9609	2.2508	2.7849

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	107.684	F2	C1	O3	111.254
F2	C1	H4	106.975	F2	C1	H5	108.512
O3	C1	H4	112.583	O3	C1	H5	106.666
H4	C1	H5	110.823

All results from a given calculation for CH₂FOH (fluoromethanol)

using model chemistry: MP2/6-31G(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: MP2/6-31G(2df,p)

States and conformations

All results from a given calculation for CH₂FOH (fluoromethanol)