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	hartrees
Energy at 0K	-214.440551
Energy at 298.15K
HF Energy	-213.918326
Nuclear repulsion energy	79.036033

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	3851	3660	47.47	64.38	0.29	0.45
2	A	3195	3037	50.49	70.66	0.50	0.67
3	A	3088	2934	77.20	106.05	0.13	0.24
4	A	1549	1472	5.61	8.21	0.72	0.84
5	A	1481	1408	52.92	4.74	0.75	0.86
6	A	1422	1351	12.66	5.40	0.75	0.86
7	A	1287	1223	5.92	6.95	0.72	0.84
8	A	1181	1123	167.04	3.20	0.34	0.51
9	A	1098	1043	110.83	2.44	0.35	0.52
10	A	1052	1000	91.65	2.74	0.55	0.71
11	A	557	529	40.97	1.92	0.62	0.76
12	A	405	385	110.87	4.51	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.015	0.508	0.048
F2	1.132	-0.309	-0.029
O3	-1.148	-0.216	-0.117
H4	0.069	1.020	1.026
H5	0.062	1.233	-0.775
H6	-1.232	-0.793	0.654

	C1	F2	O3	H4	H5	H6
C1		1.3859	1.3795	1.1047	1.0986	1.9012
F2	1.3859		2.2834	2.0022	2.0204	2.5078
O3	1.3795	2.2834		2.0765	1.9988	0.9673
H4	1.1047	2.0022	2.0765		1.8137	2.2620
H5	1.0986	2.0204	1.9988	1.8137		2.7970
H6	1.9012	2.5078	0.9673	2.2620	2.7970

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	106.907	F2	C1	O3	111.328
F2	C1	H4	106.463	F2	C1	H5	108.263
O3	C1	H4	112.952	O3	C1	H5	106.980
H4	C1	H5	110.805

All results from a given calculation for CH₂FOH (fluoromethanol)

using model chemistry: MP2=FULL/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: MP2=FULL/cc-pVDZ

States and conformations

All results from a given calculation for CH₂FOH (fluoromethanol)