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	hartrees
Energy at 0K	-167.651972
Energy at 298.15K	-167.651872
HF Energy	-167.168628
Nuclear repulsion energy	51.717343

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	1977	1907
2	Σ	1270	1225
3	Π	566	546
3	Π	496	478

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.274
C2	0.000	0.000	-0.039
O3	0.000	0.000	1.144

	N1	C2	O3
N1		1.2356	2.4181
C2	1.2356		1.1825
O3	2.4181	1.1825

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

using model chemistry: CCSD(T)/6-311G**

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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