File: divinyl%20ether.mop

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mopac 22.0.6%2Bdfsg-1
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file content (18 lines) | stat: -rw-r--r-- 867 bytes parent folder | download | duplicates (3)
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*
*    -7.066
*
 PM7
Divinyl ether
 H=-3.27 HR=C&P1970
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.33325094 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     1.37825298 +1  115.2929098 +1    0.0000000 +0     2     1     0
  C     1.36147968 +1  120.0765575 +1  179.7913928 +1     3     2     1
  C     1.33127742 +1  128.5795610 +1   -0.1038068 +1     4     3     2
  H     1.07796890 +1  122.5651399 +1 -179.9877247 +1     5     4     3
  H     1.07433783 +1  125.5693748 +1    0.0033979 +1     5     4     3
  H     1.09082121 +1  104.4837785 +1  179.9217667 +1     4     3     2
  H     1.08034991 +1  117.0790511 +1   -0.2300564 +1     2     3     4
  H     1.07623044 +1  123.1774813 +1  179.9587944 +1     1     2     3
  H     1.07877350 +1  123.4487275 +1   -0.0358563 +1     1     2     3