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	hartrees
Energy at 0K	-490.163734
Energy at 298.15K	-490.163321
Nuclear repulsion energy	70.551042

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2565	2412	9.18
2	Σ	680	640	21.96
3	Π	415	390	1.99
3	Π	395	372	6.10

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-0.646
S2	0.000	0.000	1.029
N3	0.000	0.000	-1.799

	C1	S2	N3
C1		1.6749	1.1536
S2	1.6749		2.8285
N3	1.1536	2.8285

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

using model chemistry: MP2/6-31+G**

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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