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	hartrees
Energy at 0K	-13873.235493
Energy at 298.15K
HF Energy	-13872.657341
Nuclear repulsion energy	611.882922

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3169	3027	1.00
2	A₁	1444	1379	0.24
3	A₁	496	474	0.17
4	A₁	122	117	0.02
5	A₂	1103	1053	0.00
6	B₁	3249	3103	1.51
7	B₁	741	708	8.58
8	B₂	1203	1149	106.60
9	B₂	609	582	24.14

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.049
I2	0.000	1.824	-0.091
I3	0.000	-1.824	-0.091
H4	-0.894	0.000	1.665
H5	0.894	0.000	1.665

	C1	I2	I3	H4	H5
C1		2.1508	2.1508	1.0859	1.0859
I2	2.1508		3.6479	2.6851	2.6851
I3	2.1508	3.6479		2.6851	2.6851
H4	1.0859	2.6851	2.6851		1.7885
H5	1.0859	2.6851	2.6851	1.7885

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
I2	C1	I3	115.999	I2	C1	H4	107.497
I2	C1	H5	107.497	I3	C1	H4	107.497
I3	C1	H5	107.497	H4	C1	H5	110.869

All results from a given calculation for CH₂I₂ (Diiodomethane)

using model chemistry: CCD/6-311G**

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 CH2I2 (Diiodomethane)

using model chemistry: CCD/6-311G**

States and conformations

All results from a given calculation for CH₂I₂ (Diiodomethane)