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	hartrees
Energy at 0K	-13874.178457
Energy at 298.15K
HF Energy	-13872.653867
Nuclear repulsion energy	610.505487

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3152	3152	0.92
2	A₁	1459	1459	0.00
3	A₁	491	491	0.22
4	A₁	121	121	0.02
5	A₂	1112	1112	0.00
6	B₁	3233	3233	1.94
7	B₁	749	749	10.40
8	B₂	1206	1206	103.30
9	B₂	597	597	30.31

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.054
I2	0.000	1.828	-0.091
I3	0.000	-1.828	-0.091
H4	-0.894	0.000	1.671
H5	0.894	0.000	1.671

	C1	I2	I3	H4	H5
C1		2.1570	2.1570	1.0861	1.0861
I2	2.1570		3.6554	2.6915	2.6915
I3	2.1570	3.6554		2.6915	2.6915
H4	1.0861	2.6915	2.6915		1.7886
H5	1.0861	2.6915	2.6915	1.7886

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
I2	C1	I3	115.844	I2	C1	H4	107.539
I2	C1	H5	107.539	I3	C1	H4	107.539
I3	C1	H5	107.539	H4	C1	H5	110.857

All results from a given calculation for CH₂I₂ (Diiodomethane)

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

States and conformations

All results from a given calculation for CH₂I₂ (Diiodomethane)