File: amidogen.mop

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mopac 22.0.6%2Bdfsg-1
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*    42.441
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 OPEN(1,1) SYMMETRY PM7
Amidogen
 HR=JANAF86 H=45.5
  H     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  N     0.99111754 +1    0.0000000 +0    0.0000000 +0     1     0     0
  H     0.99111754 +0  109.4985944 +1    0.0000000 +0     2     1     0
 
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