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	hartrees
Energy at 0K	-489.808313
Energy at 298.15K	-489.807966
Nuclear repulsion energy	71.448635

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2005	1816	40.49
2	Σ	764	691	11.78
3	Π	467	423	4.88
3	Π	379	343	6.26

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.624
S2	0.000	0.000	1.013
N3	0.000	0.000	-1.781

	C1	S2	N3
C1		1.6370	1.1573
S2	1.6370		2.7943
N3	1.1573	2.7943

Number	Element	Mulliken
1	C	0.127
2	S	0.065
3	N	-0.193

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

using model chemistry: HF/6-31G(2df,p)

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>	56.344
(<r²>)^1/2	7.506