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	hartrees
Energy at 0K	-167.803297
Energy at 298.15K	-167.803214
HF Energy	-167.202355
Nuclear repulsion energy	51.953010

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	1989	1913
2	Σ	1274	1225
3	Π	582	559
3	Π	504	485

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.269
C2	0.000	0.000	-0.038
O3	0.000	0.000	1.139

	N1	C2	O3
N1		1.2310	2.4078
C2	1.2310		1.1768
O3	2.4078	1.1768

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

using model chemistry: CCSD(T)/aug-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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