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	hartrees
Energy at 0K	-167.889827
Energy at 298.15K	-167.889738
HF Energy	-167.202111
Nuclear repulsion energy	52.019157

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	1996	1996
2	Σ	1273	1273
3	Π	578	578
3	Π	499	499

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.267
C2	0.000	0.000	-0.039
O3	0.000	0.000	1.137

	N1	C2	O3
N1		1.2276	2.4039
C2	1.2276		1.1763
O3	2.4039	1.1763

All results from a given calculation for NCO (isocyanato radical)

using model chemistry: QCISD(T)=FULL/cc-pVQZ

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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