
     RDKit          2D

 58 64  0  0  0  0  0  0  0  0999 V2000
   -5.5547  -10.8680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4577  -11.8910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4935  -13.0401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6067  -12.8552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3086  -10.9268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1595  -11.8910    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500  -12.4040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0105  -13.8812    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500  -12.4040    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1595  -11.8910    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7214  -13.2818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2178  -13.1771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5807  -11.7217    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3086  -10.9268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0586   -9.6278    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3191   -8.1506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0586   -6.6734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3086   -5.3743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1595   -4.4101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5000   -3.7369    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.4373   -2.9361    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500   -3.8971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000   -2.5981    0.0000 N   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
   -1.5000   -2.5981    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500   -3.8971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1595   -4.4101    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3086   -5.3743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8077   -5.3220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3207   -6.7315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7626   -7.1450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9271   -8.4849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8416   -6.1030    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2835   -6.5164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1267   -8.0082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9696   -8.7036    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3402   -8.8899    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1835  -10.3817    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6917  -10.2249    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.6752  -10.5385    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0267  -11.8735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5303  -11.9781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3895  -13.3289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.4686  -12.2869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7799   -6.4118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9411   -5.1682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8364   -3.6719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0800   -2.8331    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4882   -3.0143    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3191   -8.1506    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0586   -6.6734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0586   -9.6278    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5202   -9.9652    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  2  1  1
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  1
 11 12  1  0
 12 13  1  0
 14 13  1  6
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  1  0
 19 21  1  0
 19 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 30 31  2  0
 31 32  1  0
 32 33  1  0
 33 34  1  1
 34 35  1  0
 35 36  1  6
 36 37  2  0
 36 38  1  0
 39 38  1  6
 39 40  1  0
 40 41  2  0
 40 42  1  0
 42 43  1  0
 43 44  2  0
 43 45  2  0
 43 46  1  0
 46 47  1  0
 46 48  1  0
 48 49  1  0
 39 50  1  0
 50 51  1  0
 51 52  1  1
 52 53  1  0
 52 54  1  0
 35 55  1  0
 55 56  1  0
 55 57  1  0
 57 58  2  0
 57  5  1  0
 14 10  1  0
 31 22  1  0
 56 33  1  0
 29 24  1  0
 51 39  1  0
 49 46  1  0
M  END
