
     RDKit          2D

 60 63  0  0  0  0  0  0  0  0999 V2000
   13.4937   -2.7886    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3845   -1.7787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7045   -0.3133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1336    0.1424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5953    0.6966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9153    2.1620    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.1662    0.2409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8463   -1.2246    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0571    1.2508    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6279    0.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5188    1.8049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0897    1.3493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9805    2.3591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5514    1.9035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4422    2.9133    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0131    2.4577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3069    0.9922    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0961    3.4675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9310    4.9584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2980    5.5761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3078    4.4669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5650    3.1637    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1827    1.7968    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3077    0.5784    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6753    1.6483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5502    2.8666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9326    4.2336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8076    5.4519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1899    6.8189    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0649    8.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4472    9.4042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5575    7.8887    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2929    0.2813    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4180   -0.9370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9253   -0.7885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0504   -2.0069    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6680   -3.3738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7931   -4.5922    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1607   -3.5224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7783   -4.8893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9034   -6.1077    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2709   -5.0378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8886   -6.4048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3812   -6.5533    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2562   -5.3350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6385   -3.9680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1459   -3.8195    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5283   -2.4525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4032   -1.2342    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0356   -2.3040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2314    0.4380    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8023   -0.0176    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3406   -0.5718    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0206   -2.0373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1298   -3.0471    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8098   -4.5126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5589   -2.5915    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5915   -2.4929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2715   -3.9584    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4823   -1.4831    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  1
  3  5  1  0
  5  6  1  1
  5  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 14 13  1  1
 14 15  1  0
 15 16  1  0
 16 17  2  0
 18 16  1  1
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  2  0
 23 25  1  0
 25 26  1  1
 26 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  2  0
 30 31  1  0
 30 32  1  0
 25 33  1  0
 33 34  1  0
 34 35  2  0
 35 36  1  0
 36 37  2  0
 37 38  1  0
 37 39  1  0
 39 40  1  0
 40 41  2  0
 40 42  1  0
 42 43  2  0
 43 44  1  0
 44 45  2  0
 45 46  1  0
 46 47  2  0
 47 48  1  0
 48 49  2  0
 48 50  1  0
 14 51  1  0
 51 52  2  0
 51 53  1  0
 54 53  1  1
 54 55  1  0
 55 56  1  6
 55 57  1  0
 54 58  1  0
 58 59  1  0
 58 60  2  0
 22 18  1  0
 50 34  1  0
 50 39  2  0
 47 42  1  0
M  END
$$$$
