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	hartrees
Energy at 0K	-165.068238
Energy at 298.15K	-165.068077
HF Energy	-164.931111
Nuclear repulsion energy	49.959586

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2567	2238	5.94
2	Σ	943	822	12.11
3	Π	644	562	14.78
3	Π	547	477	9.62

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.287
C2	0.000	0.000	-0.116
O3	0.000	0.000	1.213

	N1	C2	O3
N1		1.1707	2.4993
C2	1.1707		1.3286
O3	2.4993	1.3286

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

using model chemistry: MP2/STO-3G

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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