
     RDKit          2D

 53 56  0  0  0  0  0  0  0  0999 V2000
   -9.3250   -7.4199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8285   -7.5223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1689   -8.8695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9916   -6.2775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4951   -6.3798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3928   -7.8763    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8904   -9.2897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2223   -9.9798    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0254  -10.5152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1217  -11.5390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7831  -13.0003    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3483  -13.4378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0098  -14.8991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1061  -15.9229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5408  -15.4854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8794  -14.0241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8618  -11.4618    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4860  -12.0594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8907  -13.5038    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000  -12.2636    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4860  -12.0594    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8618  -11.4618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6412  -12.7434    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0254  -10.5152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1217  -11.5390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8904   -9.2897    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3928   -7.8763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8614   -8.1815    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4951   -6.3798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9916   -6.2775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6512   -4.9303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8143   -3.6854    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4739   -2.3382    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9704   -2.2359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6300   -0.8887    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8073   -3.4807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1477   -4.8279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1899   -4.9112    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4998   -3.5794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7253   -2.7143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4760   -2.4831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1944   -1.7037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1944   -1.7037    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4760   -2.4831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4998   -3.5794    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1899   -4.9112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6033   -4.4089    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
  5  4  1  1
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  1
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
  9 17  1  0
 17 18  1  0
 18 19  2  0
 18 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  2  0
 22 24  1  0
 24 25  1  6
 24 26  1  0
 26 27  1  0
 27 28  2  0
 27 29  1  0
 29 30  1  1
 30 31  1  0
 31 32  2  0
 32 33  1  0
 33 34  2  0
 34 35  1  0
 34 36  1  0
 36 37  2  0
 29 38  1  0
 38 39  1  0
 39 40  2  0
 39 41  1  0
 41 42  2  0
 42 43  1  0
 43 44  2  0
 44 45  1  0
 45 46  2  0
 46 47  1  0
 47 48  2  0
 48 49  1  0
 49 50  1  0
 50 51  1  0
 51 52  1  0
 52 53  2  0
 52  5  1  0
 16 11  1  0
 37 31  1  0
 48 43  1  0
M  END
