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	hartrees
Energy at 0K	-2439.941058
Energy at 298.15K	-2439.942999
HF Energy	-2439.941058
Nuclear repulsion energy	100.820555

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3157	3047	5.83
2	A'	3063	2956	18.29
3	A'	2464	2378	22.01
4	A'	1498	1445	5.76
5	A'	1315	1269	11.61
6	A'	1014	978	15.37
7	A'	728	702	0.04
8	A'	619	597	0.04
9	A"	3162	3051	5.81
10	A"	1487	1435	2.86
11	A"	914	882	6.01
12	A"	154	149	3.81

Atom	x (Å)	y (Å)	z (Å)
Se1	-0.031	-0.418	0.000
C2	-0.031	1.521	0.000
H3	1.426	-0.535	0.000
H4	-1.081	1.816	0.000
H5	0.453	1.902	0.898
H6	0.453	1.902	-0.898

	Se1	C2	H3	H4	H5	H6
Se1		1.9384	1.4616	2.4682	2.5341	2.5341
C2	1.9384		2.5196	1.0907	1.0896	1.0896
H3	1.4616	2.5196		3.4368	2.7730	2.7730
H4	2.4682	1.0907	3.4368		1.7803	1.7803
H5	2.5341	1.0896	2.7730	1.7803		1.7967
H6	2.5341	1.0896	2.7730	1.7803	1.7967

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	C2	H4	105.716	Se1	C2	H5	110.470
Se1	C2	H6	110.470	C2	Se1	H3	94.602
H4	C2	H5	109.482	H4	C2	H6	109.482
H5	C2	H6	111.074

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

using model chemistry: TPSSh/6-31G(2df,p)

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: TPSSh/6-31G(2df,p)

States and conformations

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