File: geme2f2r.mop

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mopac 22.0.6%2Bdfsg-1
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file content (18 lines) | stat: -rw-r--r-- 923 bytes parent folder | download | duplicates (2)
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*
*  -130.108
*
 PM7
Dimethylgermanium difluoride
 <Ge-F> < > <F-Ge-F> <Ge-C> < > < > < > <C-Ge-F> GR=DHHM1976
  F     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Ge     1.73900000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  F     1.44848167 +1  105.4000000 +1    0.0000000 +0     2     1     0
  C     1.92800000 +1  103.7720936 +1 -117.1431359 +1     2     1     3
  C     1.93216803 +1  107.4000000 +1  117.3380174 +1     2     1     3
  H     1.09232797 +1  108.4135755 +1   56.2747027 +1     4     2     1
  H     1.09242594 +1  108.3316470 +1  -55.7898526 +1     5     2     1
  H     1.08925155 +1  108.8862957 +1  175.7380184 +1     4     2     1
  H     1.08973633 +1  109.2369956 +1  -62.9998942 +1     4     2     1
  H     1.08931274 +1  108.6580583 +1 -175.1578394 +1     5     2     1
  H     1.08984759 +1  109.2134732 +1   63.6244571 +1     5     2     1