
     RDKit          2D

 62 68  0  0  0  0  0  0  0  0999 V2000
    5.2500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7500    1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7500   -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 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    2.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2500   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0000   -2.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2500   -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
    0.2116   -5.4146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3097   -6.9114    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1725   -8.3317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1266   -9.0817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1615   -9.4595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2483  -10.6495    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8224  -12.0354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3095  -12.2311    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8836  -13.6170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3707  -13.8128    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9448  -15.1986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9704  -14.8070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5444  -16.1928    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6313  -17.3828    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2053  -18.7687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2922  -19.9587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8662  -21.3445    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3534  -21.5403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1950  -19.7629    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1081  -20.9529    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7690  -18.3771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2562  -18.1813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1441  -17.1871    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4833  -14.6112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4299  -15.8012    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0908  -13.2254    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5068  -10.1229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4833  -11.4727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0036  -10.2210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4240   -9.7389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5517   -8.7499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2152   -7.4046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6084   -7.9604    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5675   -6.8071    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7671   -5.5385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8301   -4.4088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3296   -4.3696    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0463   -3.1299    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7621   -1.8117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5469   -3.1691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8311   -4.4874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8421   -3.3596    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7552   -2.1696    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4968   -2.6962    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3133   -5.9078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0290   -4.5895    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000   -2.5981    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  6
  3  5  1  0
  5  6  1  1
  6  7  1  0
  7  8  1  6
  8  9  1  0
  9 10  1  0
 10 11  1  6
  7 12  1  0
 13 12  1  6
 13 14  1  0
 14 15  1  0
 15 16  1  6
 16 17  1  0
 17 18  2  0
 18 19  1  0
 18 20  1  0
 20 21  1  1
 22 21  1  6
 22 23  1  0
 23 24  1  0
 24 25  1  1
 25 26  1  0
 24 27  1  0
 27 28  1  6
 29 28  1  6
 29 30  1  0
 30 31  1  0
 31 32  1  1
 32 33  1  0
 31 34  1  0
 34 35  1  6
 34 36  1  0
 36 37  1  1
 36 38  1  0
 27 39  1  0
 39 40  1  1
 39 41  1  0
 20 42  1  0
 42 43  1  1
 42 44  1  0
 44 45  2  0
 45 46  1  0
 46 47  2  0
 47 48  1  0
 48 49  1  0
 50 49  1  6
 50 51  1  0
 51 52  1  6
 51 53  1  0
 53 54  1  0
 53 55  2  0
 56 55  1  1
 56 57  1  0
 57 58  2  0
 57 59  1  0
 56 60  1  0
 60 61  1  1
 15 62  1  0
 10  5  1  0
 59 13  1  0
 62  7  1  0
 41 22  1  0
 60 47  1  0
 38 29  1  0
 60 50  1  0
M  END
