
     RDKit          2D

 56 58  0  0  0  0  0  0  0  0999 V2000
    6.0944   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3444    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8444    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5517   -1.4712    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7184   -2.7184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7790   -3.7790    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4712   -3.5517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000   -3.8444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000   -5.3444    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4712   -3.5517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6507   -4.7534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7184   -2.7184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7790   -3.7790    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3908   -5.2279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9419   -5.6162    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5537   -7.0650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1048   -7.4533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6144   -8.1257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2261   -9.5746    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0632   -7.7375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1239   -8.7981    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5728   -8.4099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7357  -10.2470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4515   -6.2886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9004   -5.9004    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5517   -1.4712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9376   -2.0452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1276   -1.1321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5134   -1.7061    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7034   -0.7929    0.0000 N   0  0  0  0  0  4  0  0  0  0  0  0
   -9.8935    0.1202    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.8444    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    3.8444    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4712    3.5517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0452    4.9376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7184    2.7184    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5517    1.4712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9376    2.0452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1276    1.1321    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5134    1.7061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7034    0.7929    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0893    1.3670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2793    0.4538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2850    2.8541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6709    3.4282    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0950    3.7673    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2908    5.2544    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1008    6.1676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7092    3.1933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5192    4.1064    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7150    5.5936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  3  2  1  1
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  8  9  1  1
  8 10  1  0
 10 11  1  6
 10 12  1  0
 12 13  1  1
 14 13  1  6
 14 15  1  0
 15 16  1  0
 16 17  1  6
 16 18  1  0
 18 19  1  1
 18 20  1  0
 20 21  1  6
 21 22  1  0
 21 23  1  0
 20 24  1  0
 24 25  1  1
 12 26  1  0
 26 27  1  1
 27 28  1  0
 28 29  1  0
 29 30  2  0
 30 31  2  0
 26 32  1  0
 32 33  1  0
 33 34  1  1
 33 35  1  0
 35 36  2  0
 35 37  1  0
 37 38  2  0
 38 39  1  0
 39 40  1  0
 39 41  2  0
 41 42  1  0
 42 43  1  6
 43 44  1  0
 45 44  1  1
 45 46  1  0
 46 47  1  0
 47 48  1  1
 47 49  1  0
 49 50  1  6
 49 51  1  0
 51 52  1  6
 52 53  1  0
 51 54  1  0
 54 55  1  6
 55 56  1  0
 42  3  1  0
 54 45  1  0
 24 14  1  0
M  CHG  2  30   1  31  -1
M  END
