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	hartrees
Energy at 0K	-1870.900850
Energy at 298.15K	-1870.900250
HF Energy	-1870.132962
Nuclear repulsion energy	103.146592

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2197	2197	45.67
2	Σ	417	417	57.20
3	Π	203	203	2.67
3	Π	203	203	2.67

Atom	x (Å)	y (Å)	z (Å)
Zn1	0.000	0.000	0.783
C2	0.000	0.000	-1.181
N3	0.000	0.000	-2.344

	Zn1	C2	N3
Zn1		1.9642	3.1270
C2	1.9642		1.1628
N3	3.1270	1.1628

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

using model chemistry: QCISD/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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