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	hartrees
Energy at 0K	-213.053419
Energy at 298.15K
HF Energy	-212.726515
Nuclear repulsion energy	77.098251

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	3540	3379	7.33	82.47	0.32	0.48
2	A	3196	3051	47.92	68.03	0.43	0.60
3	A	3084	2944	75.85	80.85	0.19	0.32
4	A	1635	1561	4.40	14.78	0.73	0.85
5	A	1520	1451	41.92	9.81	0.74	0.85
6	A	1435	1370	14.82	11.24	0.75	0.86
7	A	1304	1245	8.83	11.34	0.73	0.85
8	A	1103	1053	10.53	5.78	0.45	0.62
9	A	1090	1041	166.02	3.57	0.62	0.77
10	A	1021	975	111.42	3.52	0.12	0.21
11	A	532	507	81.71	2.70	0.67	0.80
12	A	387	370	120.10	8.42	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.023	0.521	0.051
F2	1.169	-0.315	-0.031
O3	-1.187	-0.212	-0.113
H4	0.075	1.038	1.015
H5	0.042	1.236	-0.768
H6	-1.275	-0.861	0.632

	C1	F2	O3	H4	H5	H6
C1		1.4210	1.4249	1.0949	1.0872	1.9828
F2	1.4210		2.3600	2.0297	2.0539	2.5903
O3	1.4249	2.3600		2.1049	2.0093	0.9915
H4	1.0949	2.0297	2.1049		1.7945	2.3609
H5	1.0872	2.0539	2.0093	1.7945		2.8441
H6	1.9828	2.5903	0.9915	2.3609	2.8441

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	108.960	F2	C1	O3	112.049
F2	C1	H4	106.848	F2	C1	H5	109.224
O3	C1	H4	112.650	O3	C1	H5	105.441
H4	C1	H5	110.642

All results from a given calculation for CH₂FOH (fluoromethanol)

using model chemistry: MP2/3-21G

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: MP2/3-21G

States and conformations

All results from a given calculation for CH₂FOH (fluoromethanol)