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	hartrees
Energy at 0K	-214.618392
Energy at 298.15K
HF Energy	-213.992143
Nuclear repulsion energy	79.324448

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3876	3672	39.74
2	A	3187	3020	34.18
3	A	3093	2931	60.29
4	A	1576	1493	5.21
5	A	1510	1431	49.14
6	A	1434	1359	14.87
7	A	1306	1237	6.89
8	A	1171	1109	133.64
9	A	1111	1053	124.08
10	A	1054	999	130.79
11	A	565	535	41.53
12	A	396	375	126.57

Atom	x (Å)	y (Å)	z (Å)
C1	0.018	0.512	0.049
F2	1.125	-0.312	-0.028
O3	-1.142	-0.213	-0.116
H4	0.072	1.007	1.021
H5	0.073	1.227	-0.768
H6	-1.242	-0.798	0.641

	C1	F2	O3	H4	H5	H6
C1		1.3825	1.3783	1.0919	1.0866	1.9117
F2	1.3825		2.2718	1.9870	2.0054	2.5075
O3	1.3783	2.2718		2.0626	1.9942	0.9618
H4	1.0919	1.9870	2.0626		1.8023	2.2642
H5	1.0866	2.0054	1.9942	1.8023		2.7955
H6	1.9117	2.5075	0.9618	2.2642	2.7955

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O3	H6	108.234	F2	C1	O3	110.742
F2	C1	H4	106.249	F2	C1	H5	108.021
O3	C1	H4	112.712	O3	C1	H5	107.408
H4	C1	H5	111.648

All results from a given calculation for CH₂FOH (fluoromethanol)

using model chemistry: CCSD=FULL/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: CCSD=FULL/TZVP

States and conformations

All results from a given calculation for CH₂FOH (fluoromethanol)