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	hartrees
Energy at 0K	-2428.601846
Energy at 298.15K	-2428.603896
HF Energy	-2428.451535
Nuclear repulsion energy	98.581755

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3214	3069	5.28
2	A'	3126	2985	16.10
3	A'	2213	2113	68.73
4	A'	1579	1508	10.34
5	A'	1435	1370	7.03
6	A'	1056	1008	30.84
7	A'	724	691	2.99
8	A'	598	571	0.01
9	A"	3222	3076	8.03
10	A"	1569	1498	8.69
11	A"	969	925	9.83
12	A"	215	205	6.97

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	1.873	0.000
H5	0.456	1.950	0.895
H6	0.456	1.950	-0.895

	Se1	C2	H3	H4	H5	H6
Se1		1.9946	1.4912	2.5293	2.5888	2.5888
C2	1.9946		2.5865	1.0910	1.0895	1.0895
H3	1.4912	2.5865		3.5065	2.8386	2.8386
H4	2.5293	1.0910	3.5065		1.7779	1.7779
H5	2.5888	1.0895	2.8386	1.7779		1.7895
H6	2.5888	1.0895	2.8386	1.7779	1.7895

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	C2	H4	106.401	Se1	C2	H5	110.703
Se1	C2	H6	110.703	C2	Se1	H3	94.705
H4	C2	H5	109.254	H4	C2	H6	109.254
H5	C2	H6	110.425

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

using model chemistry: MP2=FULL/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=FULL/3-21G

States and conformations

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