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Mc2916

From ChemWiki

My molecule

some imformation

NH3 angle=105.741 bondlength=1.01798

force information

         Item               Value     Threshold  Converged?
 Maximum Force            0.101823     0.000450     NO 
 RMS     Force            0.068634     0.000300     NO 
 Maximum Displacement     0.187375     0.001800     NO 
 RMS     Displacement     0.123109     0.001200     NO 
 Predicted change in Energy=-4.704240D-02
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