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	hartrees
Energy at 0K	-2428.596686
Energy at 298.15K	-2428.598735
HF Energy	-2428.451522
Nuclear repulsion energy	98.554530

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3214	3067	5.33
2	A'	3126	2983	16.17
3	A'	2215	2114	68.54
4	A'	1579	1507	10.30
5	A'	1435	1369	7.16
6	A'	1056	1008	30.72
7	A'	724	691	3.00
8	A'	597	570	0.01
9	A"	3221	3074	8.09
10	A"	1569	1498	8.66
11	A"	969	925	9.79
12	A"	215	205	6.99

Atom	x (Å)	y (Å)	z (Å)
Se1	-0.032	-0.430	0.000
C2	-0.032	1.565	0.000
H3	1.454	-0.552	0.000
H4	-1.079	1.874	0.000
H5	0.456	1.950	0.895
H6	0.456	1.950	-0.895

	Se1	C2	H3	H4	H5	H6
Se1		1.9953	1.4912	2.5301	2.5894	2.5894
C2	1.9953		2.5870	1.0911	1.0896	1.0896
H3	1.4912	2.5870		3.5070	2.8390	2.8390
H4	2.5301	1.0911	3.5070		1.7783	1.7783
H5	2.5894	1.0896	2.8390	1.7783		1.7898
H6	2.5894	1.0896	2.8390	1.7783	1.7898

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	C2	H4	106.399	Se1	C2	H5	110.691
Se1	C2	H6	110.691	C2	Se1	H3	94.699
H4	C2	H5	109.264	H4	C2	H6	109.264
H5	C2	H6	110.431

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

using model chemistry: MP2/3-21G

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: MP2/3-21G

States and conformations

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