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	hartrees
Energy at 0K	-1217.264414
Energy at 298.15K
HF Energy	-1216.469931
Nuclear repulsion energy	715.101734

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	203	203	0.00
2	E	92	92	0.00
2	E	92	92	0.00
3	T₂	671	671	16.63
3	T₂	671	671	16.63
3	T₂	671	671	16.63
4	T₂	135	135	0.01
4	T₂	135	135	0.01
4	T₂	135	135	0.01

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
I2	1.237	1.237	1.237
I3	-1.237	-1.237	1.237
I4	-1.237	1.237	-1.237
I5	1.237	-1.237	-1.237

	C1	I2	I3	I4	I5
C1		2.1433	2.1433	2.1433	2.1433
I2	2.1433		3.5001	3.5001	3.5001
I3	2.1433	3.5001		3.5001	3.5001
I4	2.1433	3.5001	3.5001		3.5001
I5	2.1433	3.5001	3.5001	3.5001

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: CID/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 CI4 (tetraiodomethane)

using model chemistry: CID/cc-pVTZ-PP

States and conformations

All results from a given calculation for CI₄ (tetraiodomethane)