#! /bin/sh
$AMSBIN/ams << eor
Task SinglePoint
System
Atoms
H 0.38282500 0.00000000 5.60000000000
H -0.3828250 0.00000000 5.60000000000
O 0.00000000 0.00000000 0.00000000
Zn 0.00000000 0.00000000 2.07033600
Zn 1.95221700 0.00000000 -0.68941100
Zn -0.97572100 -1.69053600 -0.69042000
Zn -0.97586100 1.69056900 -0.69039900
O -1.70780800 2.79082900 0.92154600
C -1.54771500 2.71021500 2.20701300
O -0.89790100 1.74274000 2.77774100
H -1.98764400 3.50247700 2.84643000
O 0.35029100 2.87568900 -1.77812900
C 1.55929600 2.69704500 -2.21508600
O 2.26769700 1.64993000 -1.92250000
H 2.00771600 3.47493600 -2.86611400
O -2.56050700 1.13810100 -1.92604400
C -3.11277300 0.00091100 -2.21896700
O -2.66351100 -1.13524300 -1.78104000
H -4.00986100 0.00010300 -2.87107900
O -1.56072200 -2.87595200 0.92089600
C -1.56969400 -2.69789300 2.20650400
O -1.05725600 -1.65122100 2.77740000
H -2.03424700 -3.47599200 2.84591000
O 0.29643200 -2.78842800 -1.92295400
C 1.55740800 -2.69772600 -2.21571900
O 2.31610200 -1.73959500 -1.77889300
H 2.00724200 -3.47483300 -2.86672100
O 1.95801500 -0.09214100 2.77853700
C 3.12091400 -0.01368100 2.20790300
O 3.27101900 0.08318800 0.92238000
H 4.02685600 -0.02795200 2.84752500
End
End
Engine DFTB
ResourcesDir DFTB.org/znorg-0-1
Model DFTB0
DispersionCorrection Auto
EndEngine
eor