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	hartrees
Energy at 0K	-147.289593
Energy at 298.15K
HF Energy	-147.289593
Nuclear repulsion energy	48.069910

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	1523	3.81	12.54	0.21	0.35
2	Σ	1253	1239	15.67	39.87	0.36	0.52
3	Π	377	373	7.18	0.19	0.75	0.86
3	Π	377	373	7.18	0.19	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.306
N2	0.000	0.000	-0.044
N3	0.000	0.000	1.164

	C1	N2	N3
C1		1.2619	2.4702
N2	1.2619		1.2083
N3	2.4702	1.2083

Number	Element	Mulliken
1	C	-0.094
2	N	0.055
3	N	0.039

All results from a given calculation for CNN (Diazocarbene)

using model chemistry: PBEPBE/6-31+G**

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>	30.989
(<r²>)^1/2	5.567