
     RDKit          2D

 46 50  0  0  0  0  0  0  0  0999 V2000
    7.3711   -0.2733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8739   -0.1810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2053    1.1618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0454   -1.4314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6640   -0.8467    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1647   -0.8005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9346    0.6817    0.0000 O   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
   -0.3891   -2.2750    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0987   -3.5965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5282   -3.1418    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2831   -5.0851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9172   -6.5398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2799   -7.1668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4183   -8.6604    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5042   -6.3001    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2546   -4.8210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2553   -3.7036    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7529   -3.7894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3798   -2.4267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8734   -2.2883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7401   -3.5126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1131   -4.8753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6195   -5.0137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2027   -6.4546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8162   -7.0271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0505   -7.7641    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1999   -8.5927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6152   -9.9740    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6651   -8.9136    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1233  -10.3123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0637  -11.4809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5459  -11.2508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0878   -9.8521    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1474   -8.6835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4464   -7.9335    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3868   -6.7648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8415   -5.3354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7492   -3.8383    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1222   -2.4756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3465   -1.6089    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  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
  8 14  1  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  2  0
 19 21  1  0
 21 22  1  0
 22 23  1  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  1  0
 18 32  1  0
 32 33  1  0
 33 34  2  0
 33 35  1  0
 35 36  2  0
 36 37  1  0
 37 38  2  0
 38 39  1  0
 39 40  2  0
 40 41  1  0
 41 42  1  0
 42 43  1  0
 43 44  1  0
 44 45  1  0
 45 46  2  0
 45  4  1  0
 13  8  1  0
 31 21  1  0
 40 35  1  0
 29 24  1  0
M  END
