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	hartrees
Energy at 0K	-1871.897739
Energy at 298.15K	-1871.897018
HF Energy	-1871.897739
Nuclear repulsion energy	102.980164

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2180	2165	31.17
2	Σ	392	389	37.88
3	Π	169	168	2.42
3	Π	169	168	2.42

Atom	x (Å)	y (Å)	z (Å)
Zn1	0.000	0.000	0.784
C2	0.000	0.000	-1.180
N3	0.000	0.000	-2.349

	Zn1	C2	N3
Zn1		1.9641	3.1330
C2	1.9641		1.1689
N3	3.1330	1.1689

Number	Element	Mulliken
1	Zn	0.397
2	C	-0.361
3	N	-0.036

All results from a given calculation for ZnCN (Zinc monocyanide)

using model chemistry: PBEPBE/cc-pVTZ

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>	82.912
(<r²>)^1/2	9.106