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	hartrees
Energy at 0K	-7025.916459
Energy at 298.15K
HF Energy	-7025.605969
Nuclear repulsion energy	212.908382

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3176	2968	14.23
2	A'	1594	1489	1.10
3	A'	1381	1291	94.68
4	A'	1103	1031	113.55
5	A'	584	546	44.13
6	A'	260	243	0.76
7	A"	3250	3037	5.78
8	A"	1277	1193	1.63
9	A"	918	857	0.48

Atom	x (Å)	y (Å)	z (Å)
C1	0.543	-1.506	0.000
F2	-0.612	-2.299	0.000
I3	0.000	0.624	0.000
H4	1.124	-1.678	0.901
H5	1.124	-1.678	-0.901

	C1	F2	I3	H4	H5
C1		1.4011	2.1982	1.0855	1.0855
F2	1.4011		2.9864	2.0520	2.0520
I3	2.1982	2.9864		2.7159	2.7159
H4	1.0855	2.0520	2.7159		1.8011
H5	1.0855	2.0520	2.7159	1.8011

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	C1	I3	110.164	F2	C1	H4	110.575
F2	C1	H5	110.575	I3	C1	H4	106.628
I3	C1	H5	106.628	H4	C1	H5	112.115

All results from a given calculation for CH₂FI (fluoroiodomethane)

using model chemistry: CISD/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 CH2FI (fluoroiodomethane)

using model chemistry: CISD/3-21G*

States and conformations

All results from a given calculation for CH₂FI (fluoroiodomethane)