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	hartrees
Energy at 0K	-167.621344
Energy at 298.15K	-167.621254
HF Energy	-167.158282
Nuclear repulsion energy	51.770149

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	Σ	2057	2057
2	Σ	1257	1257
3	Π	579	579
3	Π	498	498

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	-1.274
C2	0.000	0.000	-0.036
O3	0.000	0.000	1.142

	N1	C2	O3
N1		1.2382	2.4162
C2	1.2382		1.1780
O3	2.4162	1.1780

Number	Element	Mulliken
1	N	-0.318
2	C	0.639
3	O	-0.321

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

using model chemistry: ROMP2/6-311G**

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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<r²>	32.599
(<r²>)^1/2	5.710