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	hartrees
Energy at 0K	-2438.012185
Energy at 298.15K	-2438.014246
HF Energy	-2437.762580
Nuclear repulsion energy	100.012466

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3261	3012	5.39
2	A'	3162	2921	17.69
3	A'	2465	2277	27.57
4	A'	1563	1444	6.97
5	A'	1403	1296	10.78
6	A'	1058	978	19.02
7	A'	759	701	0.74
8	A'	607	561	0.20
9	A"	3272	3023	5.08
10	A"	1554	1435	4.42
11	A"	958	885	7.84
12	A"	220	203	6.61

Atom	x (Å)	y (Å)	z (Å)
Se1	-0.032	-0.421	0.000
C2	-0.032	1.537	0.000
H3	1.446	-0.558	0.000
H4	-1.077	1.842	0.000
H5	0.455	1.912	0.896
H6	0.455	1.912	-0.896

	Se1	C2	H3	H4	H5	H6
Se1		1.9584	1.4838	2.4933	2.5470	2.5470
C2	1.9584		2.5636	1.0884	1.0868	1.0868
H3	1.4838	2.5636		3.4819	2.8086	2.8086
H4	2.4933	1.0884	3.4819		1.7757	1.7757
H5	2.5470	1.0868	2.8086	1.7757		1.7924
H6	2.5470	1.0868	2.8086	1.7757	1.7924

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	C2	H4	106.304	Se1	C2	H5	110.217
Se1	C2	H6	110.217	C2	Se1	H3	95.283
H4	C2	H5	109.441	H4	C2	H6	109.441
H5	C2	H6	111.100

All results from a given calculation for CH₃SeH (Methane selenol)

using model chemistry: CID/6-31G*

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 CH3SeH (Methane selenol)

using model chemistry: CID/6-31G*

States and conformations

All results from a given calculation for CH₃SeH (Methane selenol)