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	hartrees
Energy at 0K
Energy at 298.15K	0.071474
HF Energy	0.071474
Nuclear repulsion energy	110.551597

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	772	821	239.27
2	A₁	381	405	2.52
3	A₁	202	215	0.00
4	A₁	83	88	0.02
5	A₂	108	114	0.00
6	B₁	631	670	162.42
7	B₁	163	173	0.01
8	B₂	789	838	257.15
9	B₂	182	193	0.64

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.706
Cl2	0.000	1.404	1.750
Cl3	0.000	-1.404	1.750
I4	1.752	0.000	-0.601
I5	-1.752	0.000	-0.601

	C1	Cl2	Cl3	I4	I5
C1		1.7498	1.7498	2.1856	2.1856
Cl2	1.7498		2.8079	3.2508	3.2508
Cl3	1.7498	2.8079		3.2508	3.2508
I4	2.1856	3.2508	3.2508		3.5036
I5	2.1856	3.2508	3.2508	3.5036

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	Cl3	106.712	Cl2	C1	I4	110.909
Cl2	C1	I5	110.909	Cl3	C1	I4	110.909
Cl3	C1	I5	110.909	I4	C1	I5	106.554

All results from a given calculation for CCl₂I₂ (dichlorodiiodomethane)

using model chemistry: PM6

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 CCl2I2 (dichlorodiiodomethane)

using model chemistry: PM6

States and conformations

All results from a given calculation for CCl₂I₂ (dichlorodiiodomethane)