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	hartrees
Energy at 0K	-633.519440
Energy at 298.15K
HF Energy	-632.356343
Nuclear repulsion energy	193.029072

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3126	3126
2	A₁	1412	1412
3	A₁	502	502
4	A₁	118	118
5	A₂	1058	1058
6	B₁	3216	3216
7	B₁	726	726
8	B₂	1138	1138
9	B₂	611	611

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.055
I2	0.000	1.791	-0.091
I3	0.000	-1.791	-0.091
H4	-0.897	0.000	1.664
H5	0.897	0.000	1.664

	C1	I2	I3	H4	H5
C1		2.1264	2.1264	1.0835	1.0835
I2	2.1264		3.5816	2.6629	2.6629
I3	2.1264	3.5816		2.6629	2.6629
H4	1.0835	2.6629	2.6629		1.7932
H5	1.0835	2.6629	2.6629	1.7932

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
I2	C1	I3	114.740	I2	C1	H4	107.624
I2	C1	H5	107.624	I3	C1	H4	107.624
I3	C1	H5	107.624	H4	C1	H5	111.681

All results from a given calculation for CH₂I₂ (Diiodomethane)

using model chemistry: MP4/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 CH2I2 (Diiodomethane)

using model chemistry: MP4/Def2TZVPP

States and conformations

All results from a given calculation for CH₂I₂ (Diiodomethane)