File: ocsr.mop

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mopac 23.1.2-1
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  • size: 115,604 kB
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file content (10 lines) | stat: -rw-r--r-- 303 bytes parent folder | download | duplicates (3)
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*
*  -107.169
*
 GNORM=20000 PM7
Carbon oxyselenide
 GR=CRC05 <C-O> <C-Se>
  O     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.15900000 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Se     1.70900000 +1  180.0000000 +0    0.0000000 +0     2     1     0