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	hartrees
Energy at 0K	-147.416902
Energy at 298.15K
HF Energy	-147.416902
Nuclear repulsion energy	48.532666

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	1534	1470	2.20	39.71	0.28	0.44
2	Σ	1312	1258	13.11	18.69	0.37	0.54
3	Π	400	383	7.76	0.02	0.75	0.86
3	Π	400	383	7.76	0.02	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.291
N2	0.000	0.000	-0.048
N3	0.000	0.000	1.155

	C1	N2	N3
C1		1.2426	2.4454
N2	1.2426		1.2028
N3	2.4454	1.2028

Number	Element	Mulliken
1	C	-0.054
2	N	0.098
3	N	-0.043

All results from a given calculation for CNN (Diazocarbene)

using model chemistry: mPW1PW91/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>	30.221
(<r²>)^1/2	5.497