File: csbo2.mop

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mopac 22.0.6%2Bdfsg-1
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file content (12 lines) | stat: -rw-r--r-- 423 bytes parent folder | download | duplicates (2) 
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*  -156.804
*
 PM7
CsBO2
 H=-168.1 HR=WEPS1982
 Cs     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.34942627 +1    0.0000000 +0    0.0000000 +0     1     0     0
 XX     1.00000000 +0   90.0000000 +0    0.0000000 +0     2     1     0
  B     1.26207816 +1   90.3532022 +1  180.0000000 +0     2     3     1
  O     1.21170617 +1  141.5965410 +1  179.9996817 +1     4     3     1