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	hartrees
Energy at 0K	-7514.931014
Energy at 298.15K
HF Energy	-7514.216807
Nuclear repulsion energy	412.236629

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3204	3204	4.27
2	A	1378	1378	20.80
3	A	1251	1251	109.81
4	A	1129	1129	187.14
5	A	809	809	176.57
6	A	599	599	38.27
7	A	426	426	0.86
8	A	278	278	0.14
9	A	200	200	0.01

Atom	x (Å)	y (Å)	z (Å)
C1	1.001	0.469	0.415
H2	1.075	0.611	1.489
F3	1.278	1.633	-0.209
Cl4	2.176	-0.753	-0.071
I5	-1.049	-0.100	-0.017

	C1	H2	F3	Cl4	I5
C1		1.0859	1.3503	1.7630	2.1710
H2	1.0859		1.9928	2.3464	2.6991
F3	1.3503	1.9928		2.5531	2.9082
Cl4	1.7630	2.3464	2.5531		3.2905
I5	2.1710	2.6991	2.9082	3.2905

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	109.292	H2	C1	Cl4	108.560
H2	C1	I5	107.185	F3	C1	Cl4	109.470
F3	C1	I5	109.129	Cl4	C1	I5	113.126

All results from a given calculation for CHFClI (fluorochloroiodomethane)

using model chemistry: CCSD/6-311G**

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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