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	hartrees
Energy at 0K	-167.793989
Energy at 298.15K	-167.793959
HF Energy	-167.189837
Nuclear repulsion energy	51.981172

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	2314	2228
2	Σ	1280	1232
3	Π	604	582
3	Π	556	535

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.272
C2	0.000	0.000	-0.031
O3	0.000	0.000	1.136

	N1	C2	O3
N1		1.2408	2.4077
C2	1.2408		1.1669
O3	2.4077	1.1669

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

using model chemistry: MP4=FULL/cc-pVTZ

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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