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	hartrees
Energy at 0K	-1872.226653
Energy at 298.15K	-1872.225996
HF Energy	-1872.226653
Nuclear repulsion energy	103.205042

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2240	2240	29.84
2	Σ	399	399	48.47
3	Π	189	189	2.87
3	Π	189	189	2.87

Atom	x (Å)	y (Å)	z (Å)
Zn1	0.000	0.000	0.783
C2	0.000	0.000	-1.182
N3	0.000	0.000	-2.342

	Zn1	C2	N3
Zn1		1.9643	3.1248
C2	1.9643		1.1605
N3	3.1248	1.1605

Number	Element	Mulliken
1	Zn	0.285
2	C	-0.277
3	N	-0.007

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

using model chemistry: TPSSh/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>	82.721
(<r²>)^1/2	9.095