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	hartrees
Energy at 0K	-27448.414229
Energy at 298.15K
HF Energy	-27448.414229
Nuclear repulsion energy	2727.021374

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	184	170	0.00	19.17	0.00	0.00
2	E	85	79	0.00	4.25	0.75	0.86
2	E	85	79	0.00	4.25	0.75	0.86
3	T₂	574	531	136.75	8.26	0.75	0.86
3	T₂	574	531	136.75	8.26	0.75	0.86
3	T₂	574	531	136.75	8.26	0.75	0.86
4	T₂	128	118	0.00	6.70	0.75	0.86
4	T₂	128	118	0.00	6.70	0.75	0.86
4	T₂	128	118	0.00	6.70	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
I2	1.299	1.299	1.299
I3	-1.299	-1.299	1.299
I4	-1.299	1.299	-1.299
I5	1.299	-1.299	-1.299

	C1	I2	I3	I4	I5
C1		2.2496	2.2496	2.2496	2.2496
I2	2.2496		3.6736	3.6736	3.6736
I3	2.2496	3.6736		3.6736	3.6736
I4	2.2496	3.6736	3.6736		3.6736
I5	2.2496	3.6736	3.6736	3.6736

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
I2	C1	I3	109.471	I2	C1	I4	109.471
I2	C1	I5	109.471	I3	C1	I4	109.471
I3	C1	I5	109.471	I4	C1	I5	109.471

All results from a given calculation for CI₄ (tetraiodomethane)

using model chemistry: BLYP/STO-3G

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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Number	Element	Mulliken
1	C	-0.255
2	I	0.064
3	I	0.064
4	I	0.064
5	I	0.064

<r²>	1142.328
(<r²>)^1/2	33.798

All results from a given calculation for CI4 (tetraiodomethane)

using model chemistry: BLYP/STO-3G

States and conformations

All results from a given calculation for CI₄ (tetraiodomethane)