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	hartrees
Energy at 0K	-1226.970580
Energy at 298.15K
HF Energy	-1224.463170
Nuclear repulsion energy	712.512174

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.000
I2	1.242	1.242	1.242
I3	-1.242	-1.242	1.242
I4	-1.242	1.242	-1.242
I5	1.242	-1.242	-1.242

	C1	I2	I3	I4	I5
C1		2.1512	2.1512	2.1512	2.1512
I2	2.1512		3.5129	3.5129	3.5129
I3	2.1512	3.5129		3.5129	3.5129
I4	2.1512	3.5129	3.5129		3.5129
I5	2.1512	3.5129	3.5129	3.5129

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: MP4=FULL/Def2TZVPP

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: MP4=FULL/Def2TZVPP

States and conformations

All results from a given calculation for CI₄ (tetraiodomethane)