File: formamide.mop

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mopac 23.1.2-1
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file content (13 lines) | stat: -rw-r--r-- 495 bytes parent folder | download | duplicates (3) 
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*
*   -44.096
*
 PM7
Formamide
 HR=NIST H=-44.5
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  N     1.38420176 +1    0.0000000 +0    0.0000000 +0     1     0     0
  H     0.99280365 +1  123.2947062 +1    0.0000000 +0     2     1     0
  H     1.09765385 +1  116.2899987 +1   -0.0064427 +1     1     2     3
  O     1.21200033 +1  119.8777041 +1  179.9978614 +1     1     2     3
  H     1.00034764 +1  120.1401282 +1    0.0006209 +1     2     1     5