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	hartrees
Energy at 0K	-7514.922777
Energy at 298.15K
HF Energy	-7514.217040
Nuclear repulsion energy	412.699083

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3234	3234	3.50
2	A	1389	1389	21.56
3	A	1258	1258	108.75
4	A	1151	1151	189.59
5	A	815	815	176.71
6	A	602	602	38.80
7	A	430	430	0.92
8	A	280	280	0.15
9	A	201	201	0.01

Atom	x (Å)	y (Å)	z (Å)
C1	1.001	0.469	0.414
H2	1.073	0.610	1.486
F3	1.277	1.629	-0.209
Cl4	2.175	-0.751	-0.071
I5	-1.048	-0.100	-0.017

	C1	H2	F3	Cl4	I5
C1		1.0838	1.3448	1.7610	2.1704
H2	1.0838		1.9882	2.3432	2.6954
F3	1.3448	1.9882		2.5472	2.9037
Cl4	1.7610	2.3432	2.5472		3.2886
I5	2.1704	2.6954	2.9037	3.2886

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	C1	F3	109.435	H2	C1	Cl4	108.554
H2	C1	I5	107.060	F3	C1	Cl4	109.464
F3	C1	I5	109.120	Cl4	C1	I5	113.134

All results from a given calculation for CHFClI (fluorochloroiodomethane)

using model chemistry: MP3/6-311G**

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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