
     RDKit          2D

 50 53  0  0  0  0  0  0  0  0999 V2000
   -7.5423    4.6176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1038    4.1926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0165    5.2259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7526    2.7343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3141    2.3093    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9629    0.8510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0502   -0.1823    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5243    0.4260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1731   -1.0323    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7346   -1.4573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3527   -0.4240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3834   -2.9156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4707   -3.9489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9093   -3.5239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2605   -2.0656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6990   -1.6406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7863   -2.6739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2249   -2.2489    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4351   -4.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9966   -4.5572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0551   -3.3406    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1425   -2.3073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7913   -0.8490    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5810   -2.7323    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6683   -1.6990    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1069   -2.1240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4581   -3.5823    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1942   -1.0907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6327   -1.5157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7200   -0.4824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1586   -0.9075    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.2459    0.1259    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6844   -0.2992    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8947    1.5842    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9820    2.6175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6308    4.0758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1923    4.5008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1050    3.4675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4562    2.0092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3688    0.9759    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8399    1.7010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4887    0.2427    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2785    2.1260    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7802    3.5396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2796    3.4993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7046    2.0608    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4678    1.2120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4275   -0.2874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7059   -1.0721    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1088   -1.0022    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  6
  5  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  1  1
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 17 19  1  0
 19 20  2  0
 12 21  1  0
 21 22  1  0
 22 23  2  0
 22 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  2  0
 26 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  2  0
 31 32  1  0
 32 33  2  0
 32 34  1  0
 34 35  2  0
 35 36  1  0
 36 37  2  0
 37 38  1  0
 38 39  2  0
 39 40  1  0
  4 41  1  0
 41 42  2  0
 41 43  1  0
 43 44  1  0
 44 45  1  0
 45 46  1  0
 46 47  1  0
 47 48  1  6
 48 49  1  0
 48 50  2  0
 20 14  1  0
 40 30  1  0
 47 43  1  0
 39 34  1  0
M  END
$$$$
