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	hartrees
Energy at 0K	-13874.222275
Energy at 298.15K
HF Energy	-13872.653935
Nuclear repulsion energy	612.640360

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	3169	3002	0.12	77.17	0.09	0.16
2	A₁	1458	1381	0.00	15.50	0.58	0.73
3	A₁	498	472	0.23	14.60	0.10	0.19
4	A₁	122	115	0.02	4.70	0.43	0.60
5	A₂	1114	1055	0.00	4.12	0.75	0.86
6	B₁	3257	3085	3.83	47.50	0.75	0.86
7	B₁	754	714	11.36	1.55	0.75	0.86
8	B₂	1207	1143	97.36	0.04	0.75	0.86
9	B₂	603	571	32.38	8.44	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.054
I2	0.000	1.821	-0.091
I3	0.000	-1.821	-0.091
H4	-0.895	0.000	1.668
H5	0.895	0.000	1.668

	C1	I2	I3	H4	H5
C1		2.1507	2.1507	1.0851	1.0851
I2	2.1507		3.6413	2.6848	2.6848
I3	2.1507	3.6413		2.6848	2.6848
H4	1.0851	2.6848	2.6848		1.7895
H5	1.0851	2.6848	2.6848	1.7895

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
I2	C1	I3	115.681	I2	C1	H4	107.527
I2	C1	H5	107.527	I3	C1	H4	107.527
I3	C1	H5	107.527	H4	C1	H5	111.088

All results from a given calculation for CH₂I₂ (Diiodomethane)

using model chemistry: MP2=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: MP2=FULL/6-311G*

States and conformations

All results from a given calculation for CH₂I₂ (Diiodomethane)