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	hartrees
Energy at 0K	-2479.775003
Energy at 298.15K	-2479.779137
HF Energy	-2479.141922
Nuclear repulsion energy	187.316073

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3176	3040	7.89
2	A₁	3074	2942	21.88
3	A₁	1507	1442	0.74
4	A₁	1356	1297	1.34
5	A₁	997	954	14.14
6	A₁	624	597	0.06
7	A₁	216	207	0.00
8	A₂	3173	3036	0.00
9	A₂	1487	1423	0.00
10	A₂	919	879	0.00
11	A₂	149	143	0.00
12	B₁	3167	3030	11.77
13	B₁	1496	1432	11.28
14	B₁	946	905	6.76
15	B₁	157	150	0.20
16	B₂	3177	3040	2.42
17	B₂	3078	2946	20.33
18	B₂	1500	1436	12.41
19	B₂	1335	1278	6.96
20	B₂	876	838	0.13
21	B₂	642	614	1.07

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.475
C2	0.000	1.443	-0.821
C3	0.000	-1.443	-0.821
H4	0.000	2.378	-0.265
H5	0.000	-2.378	-0.265
H6	0.893	1.391	-1.439
H7	-0.893	1.391	-1.439
H8	-0.893	-1.391	-1.439
H9	0.893	-1.391	-1.439

	Se1	C2	C3	H4	H5	H6	H7	H8	H9
Se1		1.9392	1.9392	2.4902	2.4902	2.5285	2.5285	2.5285	2.5285
C2	1.9392		2.8864	1.0874	3.8613	1.0874	1.0874	3.0351	3.0351
C3	1.9392	2.8864		3.8613	1.0874	3.0351	3.0351	1.0874	1.0874
H4	2.4902	1.0874	3.8613		4.7557	1.7747	1.7747	4.0471	4.0471
H5	2.4902	3.8613	1.0874	4.7557		4.0471	4.0471	1.7747	1.7747
H6	2.5285	1.0874	3.0351	1.7747	4.0471		1.7862	3.3058	2.7817
H7	2.5285	1.0874	3.0351	1.7747	4.0471	1.7862		2.7817	3.3058
H8	2.5285	3.0351	1.0874	4.0471	1.7747	3.3058	2.7817		1.7862
H9	2.5285	3.0351	1.0874	4.0471	1.7747	2.7817	3.3058	1.7862

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	C2	H4	107.353	Se1	C2	H6	110.111
Se1	C2	H7	110.111	Se1	C3	H5	107.353
Se1	C3	H8	110.111	Se1	C3	H9	110.111
C2	Se1	C3	96.183	H4	C2	H6	109.385
H4	C2	H7	109.385	H5	C3	H8	109.385
H5	C3	H9	109.385	H6	C2	H7	110.437
H8	C3	H9	110.437

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)

using model chemistry: CCD/aug-cc-pVTZ

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 CH3SeCH3 (dimethylselenide)

using model chemistry: CCD/aug-cc-pVTZ

States and conformations

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)