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	hartrees
Energy at 0K	-1871.111281
Energy at 298.15K	-1871.110746
HF Energy	-1870.150031
Nuclear repulsion energy	104.801249

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	3657	3544	1578.98
2	Σ	455	441	70.76
3	Π	212	205	6.98
3	Π	212	205	6.98

Atom	x (Å)	y (Å)	z (Å)
Zn1	0.000	0.000	0.769
C2	0.000	0.000	-1.149
N3	0.000	0.000	-2.313

	Zn1	C2	N3
Zn1		1.9182	3.0824
C2	1.9182		1.1642
N3	3.0824	1.1642

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

using model chemistry: MP2=FULL/aug-cc-pVDZ

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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