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	hartrees
Energy at 0K	-2479.540652
Energy at 298.15K	-2479.544731
HF Energy	-2479.042674
Nuclear repulsion energy	185.360187

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3167	3054	10.22
2	A₁	3058	2949	25.24
3	A₁	1471	1419	0.35
4	A₁	1333	1285	2.55
5	A₁	984	949	13.29
6	A₁	608	587	0.09
7	A₁	212	204	0.00
8	A₂	3159	3047	0.00
9	A₂	1452	1400	0.00
10	A₂	902	870	0.00
11	A₂	145	140	0.00
12	B₁	3153	3042	16.25
13	B₁	1462	1410	9.63
14	B₁	931	898	7.00
15	B₁	153	148	0.19
16	B₂	3167	3055	4.80
17	B₂	3061	2952	22.82
18	B₂	1465	1413	11.21
19	B₂	1310	1264	9.96
20	B₂	867	836	0.13
21	B₂	627	604	0.84

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.481
C2	0.000	1.454	-0.831
C3	0.000	-1.454	-0.831
H4	0.000	2.404	-0.275
H5	0.000	-2.404	-0.275
H6	0.903	1.401	-1.458
H7	-0.903	1.401	-1.458
H8	-0.903	-1.401	-1.458
H9	0.903	-1.401	-1.458

	Se1	C2	C3	H4	H5	H6	H7	H8	H9
Se1		1.9589	1.9589	2.5206	2.5206	2.5570	2.5570	2.5570	2.5570
C2	1.9589		2.9087	1.1007	3.8986	1.1008	1.1008	3.0595	3.0595
C3	1.9589	2.9087		3.8986	1.1007	3.0595	3.0595	1.1008	1.1008
H4	2.5206	1.1007	3.8986		4.8089	1.7950	1.7950	4.0858	4.0858
H5	2.5206	3.8986	1.1007	4.8089		4.0858	4.0858	1.7950	1.7950
H6	2.5570	1.1008	3.0595	1.7950	4.0858		1.8068	3.3335	2.8015
H7	2.5570	1.1008	3.0595	1.7950	4.0858	1.8068		2.8015	3.3335
H8	2.5570	3.0595	1.1008	4.0858	1.7950	3.3335	2.8015		1.8068
H9	2.5570	3.0595	1.1008	4.0858	1.7950	2.8015	3.3335	1.8068

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	C2	H4	107.608	Se1	C2	H6	110.199
Se1	C2	H7	110.199	Se1	C3	H5	107.608
Se1	C3	H8	110.199	Se1	C3	H9	110.199
C2	Se1	C3	95.875	H4	C2	H6	109.241
H4	C2	H7	109.241	H5	C3	H8	109.241
H5	C3	H9	109.241	H6	C2	H7	110.298
H8	C3	H9	110.298

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)

using model chemistry: CCD/aug-cc-pVDZ

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-pVDZ

States and conformations

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)