File: auf2shr.mop

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mopac 22.0.6%2Bdfsg-1
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*     7.551
*
 PM7
Gold(III) difluoride thiol
 <Au-S> <Au-F> <S-Au-F> GR=PW91D
 Au     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  S     2.34199300 +1    0.0000000 +0    0.0000000 +0     1     0     0
  F     2.02510100 +1   89.3693700 +1    0.0000000 +0     1     2     0
  F     1.51251601 +1   93.8008751 +1 -179.9949716 +1     1     2     3
  H     1.35943812 +1   94.1113095 +1   -0.1831876 +1     2     1     3