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	hartrees
Energy at 0K	-487.555752
Energy at 298.15K	-487.555502
Nuclear repulsion energy	68.845206

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2935	2802	21.23
2	Σ	644	615	26.30
3	Π	520	497	2.39
3	Π	500	478	3.42

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.690
S2	0.000	0.000	1.062
N3	0.000	0.000	-1.836

	C1	S2	N3
C1		1.7516	1.1463
S2	1.7516		2.8978
N3	1.1463	2.8978

All results from a given calculation for SCN (thiocyanato radical)

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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