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	hartrees
Energy at 0K	-2440.531785
Energy at 298.15K	-2440.533810
HF Energy	-2440.094299
Nuclear repulsion energy	100.529362

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3182	2995	5.25
2	A'	3089	2908	17.78
3	A'	2492	2346	21.35
4	A'	1501	1413	5.84
5	A'	1340	1261	10.11
6	A'	1021	961	15.25
7	A'	727	684	0.49
8	A'	613	577	0.02
9	A"	3191	3003	4.23
10	A"	1489	1402	3.75
11	A"	930	876	5.99
12	A"	201	189	4.79

Atom	x (Å)	y (Å)	z (Å)
Se1	-0.031	-0.420	0.000
C2	-0.031	1.530	0.000
H3	1.419	-0.547	0.000
H4	-1.076	1.829	0.000
H5	0.453	1.910	0.893
H6	0.453	1.910	-0.893

	Se1	C2	H3	H4	H5	H6
Se1		1.9501	1.4560	2.4800	2.5423	2.5423
C2	1.9501		2.5337	1.0865	1.0849	1.0849
H3	1.4560	2.5337		3.4458	2.7881	2.7881
H4	2.4800	1.0865	3.4458		1.7721	1.7721
H5	2.5423	1.0849	2.7881	1.7721		1.7869
H6	2.5423	1.0849	2.7881	1.7721	1.7869

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Se1	C2	H4	105.986	Se1	C2	H5	110.524
Se1	C2	H6	110.524	C2	Se1	H3	95.015
H4	C2	H5	109.397	H4	C2	H6	109.397
H5	C2	H6	110.885

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

using model chemistry: CCSD/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 CH3SeH (Methane selenol)

using model chemistry: CCSD/cc-pVTZ

States and conformations

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