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	hartrees
Energy at 0K	-13873.223275
Energy at 298.15K
HF Energy	-13872.653855
Nuclear repulsion energy	610.629407

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3148	3002	0.97
2	A₁	1458	1390	0.01
3	A₁	491	468	0.26
4	A₁	121	116	0.03
5	A₂	1112	1060	0.00
6	B₁	3230	3080	1.86
7	B₁	750	715	10.24
8	B₂	1205	1149	104.27
9	B₂	596	568	31.22

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.055
I2	0.000	1.827	-0.091
I3	0.000	-1.827	-0.091
H4	-0.895	0.000	1.671
H5	0.895	0.000	1.671

	C1	I2	I3	H4	H5
C1		2.1567	2.1567	1.0864	1.0864
I2	2.1567		3.6544	2.6914	2.6914
I3	2.1567	3.6544		2.6914	2.6914
H4	1.0864	2.6914	2.6914		1.7898
H5	1.0864	2.6914	2.6914	1.7898

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
I2	C1	I3	115.818	I2	C1	H4	107.533
I2	C1	H5	107.533	I3	C1	H4	107.533
I3	C1	H5	107.533	H4	C1	H5	110.909

All results from a given calculation for CH₂I₂ (Diiodomethane)

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

States and conformations

All results from a given calculation for CH₂I₂ (Diiodomethane)