File: sb2f4.mop

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mopac 22.0.6%2Bdfsg-1
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file content (13 lines) | stat: -rw-r--r-- 493 bytes parent folder | download | duplicates (2)
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*
*  -213.473
*
 PM7
Sb2F4
 H=-224.0 HR=PW91D
 Sb     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Sb     3.04926200 +1    0.0000000 +0    0.0000000 +0     1     0     0
  F     1.95113030 +1   87.3553502 +1    0.0000000 +0     2     1     0
  F     1.95237534 +1   86.6498211 +1   95.4374349 +1     2     1     3
  F     1.95118392 +1   87.3603810 +1   79.5814844 +1     1     2     3
  F     1.95239128 +1   86.6493234 +1   95.4223230 +1     1     2     5