File: mgor.mop

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mopac 22.0.6%2Bdfsg-1
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*
*  -111.626
*
 PM7
Magnesium oxide
 <Mg-O> GR=JANAF86
 Mg     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     1.74900000 +1    0.0000000 +0    0.0000000 +0     1     0     0