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	hartrees
Energy at 0K	-167.825535
Energy at 298.15K	-167.825514
HF Energy	-167.189023
Nuclear repulsion energy	52.017668

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	2321	2321
2	Σ	1274	1274
3	Π	615	615
3	Π	563	563

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.272
C2	0.000	0.000	-0.030
O3	0.000	0.000	1.135

	N1	C2	O3
N1		1.2420	2.4069
C2	1.2420		1.1649
O3	2.4069	1.1649

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

using model chemistry: MP4=FULL/6-311+G(3df,2p)

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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