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	hartrees
Energy at 0K	-489.938269
Energy at 298.15K	-489.937790
Nuclear repulsion energy	68.689857

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2286	2144	1.15
2	Σ	655	614	20.56
3	Π	399	374	3.14
3	Π	360	338	4.17

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.674
S2	0.000	0.000	1.060
N3	0.000	0.000	-1.845

	C1	S2	N3
C1		1.7333	1.1712
S2	1.7333		2.9045
N3	1.1712	2.9045

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

using model chemistry: CISD/6-31G

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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