
     RDKit          2D

 42 45  0  0  0  0  0  0  0  0999 V2000
   -7.1468  -11.4034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0240  -12.3981    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6012  -11.9231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3012  -10.4534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8784   -9.9784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7556  -10.9731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3328  -10.4981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0327   -9.0284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3901   -8.5534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5128   -9.5481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6901   -7.0837    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3349   -6.4407    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5662   -5.2415    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8068   -3.7609    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3318   -2.3381    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 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000    2.5981    0.0000 C   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
    0.7500    3.8971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000    5.1962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500    6.4952    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500    6.4952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000    5.1962    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
    2.1908   -0.8817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1304    0.6171    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6605   -1.1818    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8224   -2.1304    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4103   -3.5104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8909   -3.2698    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2896   -5.0055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7124   -5.4805    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4879   -6.2733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1889   -7.0233    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0556  -12.4428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4784  -12.9178    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7785  -14.3875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6557  -15.3821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  2  0
 19 27  1  0
 27 28  1  0
 16 29  1  0
 29 30  2  0
 29 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 33 35  1  0
 35 36  1  0
 35 37  1  0
 37 38  1  0
  6 39  1  0
 39 40  2  0
 40 41  1  0
 41 42  1  0
 40  3  1  0
 38 11  1  0
 28 16  1  0
 26 21  1  0
M  END
