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	hartrees
Energy at 0K	-2479.805768
Energy at 298.15K
HF Energy	-2479.141681
Nuclear repulsion energy	186.771122

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.479
C2	0.000	1.442	-0.828
C3	0.000	-1.442	-0.828
H4	0.000	2.382	-0.276
H5	0.000	-2.382	-0.276
H6	0.896	1.383	-1.446
H7	-0.896	1.383	-1.446
H8	-0.896	-1.383	-1.446
H9	0.896	-1.383	-1.446

	Se1	C2	C3	H4	H5	H6	H7	H8	H9
Se1		1.9464	1.9464	2.4983	2.4983	2.5339	2.5339	2.5339	2.5339
C2	1.9464		2.8845	1.0898	3.8636	1.0898	1.0898	3.0274	3.0274
C3	1.9464	2.8845		3.8636	1.0898	3.0274	3.0274	1.0898	1.0898
H4	2.4983	1.0898	3.8636		4.7632	1.7804	1.7804	4.0427	4.0427
H5	2.4983	3.8636	1.0898	4.7632		4.0427	4.0427	1.7804	1.7804
H6	2.5339	1.0898	3.0274	1.7804	4.0427		1.7912	3.2951	2.7657
H7	2.5339	1.0898	3.0274	1.7804	4.0427	1.7912		2.7657	3.2951
H8	2.5339	3.0274	1.0898	4.0427	1.7804	3.2951	2.7657		1.7912
H9	2.5339	3.0274	1.0898	4.0427	1.7804	2.7657	3.2951	1.7912

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	C2	H4	107.352	Se1	C2	H6	109.904
Se1	C2	H7	109.904	Se1	C3	H5	107.352
Se1	C3	H8	109.904	Se1	C3	H9	109.904
C2	Se1	C3	95.629	H4	C2	H6	109.543
H4	C2	H7	109.543	H5	C3	H8	109.543
H5	C3	H9	109.543	H6	C2	H7	110.535
H8	C3	H9	110.535

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)

using model chemistry: QCISD(T)/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: QCISD(T)/aug-cc-pVTZ

States and conformations

All results from a given calculation for CH₃SeCH₃ (dimethylselenide)