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	hartrees
Energy at 0K	-24.994748
Energy at 298.15K	-24.994255
Nuclear repulsion energy	21.829597

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	1796	1639	62.82
2	Σ	684	624	11.85
3	Π	381	348	1.70
3	Π	341	311	2.32

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.657
S2	0.000	0.000	1.053
N3	0.000	0.000	-1.843

	C1	S2	N3
C1		1.7097	1.1865
S2	1.7097		2.8962
N3	1.1865	2.8962

Number	Element	Mulliken
1	C	-0.444
2	S	0.293
3	N	0.151

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

using model chemistry: HF/CEP-121G

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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<r²>	40.873
(<r²>)^1/2	6.393