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	hartrees
Energy at 0K	-1869.336680
Energy at 298.15K	-1869.335796
HF Energy	-1869.336680
Nuclear repulsion energy	110.615173

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2117	2117	160.48
2	Σ	454	454	27.80
3	Π	104	104	0.84
3	Π	104	104	0.84

Atom	x (Å)	y (Å)	z (Å)
Zn1	0.000	0.000	0.722
N2	0.000	0.000	-1.125
C3	0.000	0.000	-2.299

	Zn1	N2	C3
Zn1		1.8468	3.0216
N2	1.8468		1.1748
C3	3.0216	1.1748

Number	Element	Mulliken
1	Zn	0.165
2	N	-0.156
3	C	-0.009

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

using model chemistry: SVWN/6-311+G(3df,2p)

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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	x	y	z
x	5.941	0.000	0.000
y	0.000	5.941	-0.000
z	0.000	-0.000	11.776

<r²>	73.823
(<r²>)^1/2	8.592