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	hartrees
Energy at 0K	-147.289658
Energy at 298.15K
HF Energy	-147.289658
Nuclear repulsion energy	48.525468

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ	1540	1480	2.81	36.65	0.28	0.44
2	Σ	1317	1266	13.09	20.74	0.37	0.54
3	Π	401	386	7.94	0.03	0.75	0.86
3	Π	401	386	7.94	0.03	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.292
N2	0.000	0.000	-0.047
N3	0.000	0.000	1.154

	C1	N2	N3
C1		1.2440	2.4460
N2	1.2440		1.2019
N3	2.4460	1.2019

Number	Element	Mulliken
1	C	-0.057
2	N	0.099
3	N	-0.042

All results from a given calculation for CNN (Diazocarbene)

using model chemistry: PBE1PBE/cc-pVDZ

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>	30.249
(<r²>)^1/2	5.500