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	hartrees
Energy at 0K	-147.459129
Energy at 298.15K
HF Energy	-147.459129
Nuclear repulsion energy	48.975386

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	1526	1526	0.84	48.72	0.23	0.37
2	Σ	1311	1311	16.40	18.45	0.33	0.50
3	Π	417	417	6.88	0.09	0.75	0.86
3	Π	417	417	6.88	0.09	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.279
N2	0.000	0.000	-0.049
N3	0.000	0.000	1.144

	C1	N2	N3
C1		1.2300	2.4231
N2	1.2300		1.1931
N3	2.4231	1.1931

Number	Element	Mulliken
1	C	-0.121
2	N	0.199
3	N	-0.078

All results from a given calculation for CNN (Diazocarbene)

using model chemistry: mPW1PW91/Def2TZVPP

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>	30.040
(<r²>)^1/2	5.481