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	hartrees
Energy at 0K	-1547.248230
Energy at 298.15K
HF Energy	-1546.190478
Nuclear repulsion energy	557.859633

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	711	711
2	A₁	348	348
3	A₁	206	206
4	A₁	111	111
5	A₂	154	154
6	B₁	637	637
7	B₁	193	193
8	B₂	746	746
9	B₂	228	228

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.663
Cl2	0.000	1.453	1.695
Cl3	0.000	-1.453	1.695
I4	1.775	0.000	-0.581
I5	-1.775	0.000	-0.581

	C1	Cl2	Cl3	I4	I5
C1		1.7827	1.7827	2.1680	2.1680
Cl2	1.7827		2.9062	3.2323	3.2323
Cl3	1.7827	2.9062		3.2323	3.2323
I4	2.1680	3.2323	3.2323		3.5510
I5	2.1680	3.2323	3.2323	3.5510

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	C1	Cl3	109.195	Cl2	C1	I4	109.416
Cl2	C1	I5	109.416	Cl3	C1	I4	109.416
Cl3	C1	I5	109.416	I4	C1	I5	109.963

All results from a given calculation for CCl₂I₂ (dichlorodiiodomethane)

using model chemistry: MP4/cc-pVTZ-PP

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: MP4/cc-pVTZ-PP

States and conformations

All results from a given calculation for CCl₂I₂ (dichlorodiiodomethane)