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	hartrees
Energy at 0K	-1872.330101
Energy at 298.15K
HF Energy	-1872.330101
Nuclear repulsion energy	108.838798

Atom	x (Å)	y (Å)	z (Å)
Zn1	0.000	0.000	0.735
N2	0.000	0.000	-1.156
C3	0.000	0.000	-2.328

	Zn1	N2	C3
Zn1		1.8907	3.0628
N2	1.8907		1.1721
C3	3.0628	1.1721

Number	Element	Mulliken
1	Zn	0.542
2	N	-0.451
3	C	-0.091

	x	y	z	Total
	0.000	0.000	4.581	4.581
CHELPG
AIM
ESP

All results from a given calculation for ZnNC (Zinc isocyanide)

using model chemistry: B3LYP/cc-pVQZ

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>	75.763
(<r²>)^1/2	8.704