
     RDKit          2D

 62 68  0  0  0  0  0  0  0  0999 V2000
    1.7116   -2.8165    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
    2.2500    1.2990    0.0000 O   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
    4.5000    2.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2500    3.8971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7500    3.8971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2500    1.2990    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
   -0.0000    2.5981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0000    5.1962    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
   -1.5000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9968   -0.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3421   -0.7615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3311   -1.8893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6302   -1.1393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8133   -3.3097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3004   -3.1139    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2136   -4.3039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6396   -5.6898    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5527   -6.8798    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9787   -8.2656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0399   -6.6840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9530   -7.8740    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.4402   -7.6782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.3533   -8.8683    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.8405   -8.6725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.7536   -9.8625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.4145   -7.2867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.9017   -7.0909    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5014   -6.0966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.0754   -4.7108    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -16.5626   -4.5150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.0142   -6.2924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6139   -5.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.1011   -5.1024    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6751   -3.7166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7008   -4.1081    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7152   -4.8065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0517   -6.1518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9240   -7.1408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5036   -7.6230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0068   -7.5249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7916   -9.0093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6868   -9.2634    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3852   -7.9359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8950   -8.2916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6788   -9.5706    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6108   -6.9734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8270   -5.6944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3275   -5.7337    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3385   -6.8614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8380   -6.8222    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8097   -4.3133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2969   -4.5091    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1103   -6.9341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7778   -5.3956    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  2  1  0
  2  3  1  1
  4  3  1  1
  4  5  1  0
  6  5  1  1
  6  7  1  0
  7  8  1  0
  8  9  1  0
  7 10  1  6
  6 11  1  0
 11 12  1  0
 12 13  1  0
 11 14  1  6
  4 15  1  0
 15 16  1  0
 16 17  1  1
 17 18  1  0
 18 19  2  0
 19 20  1  0
 19 21  1  0
 21 22  1  6
 23 22  1  6
 23 24  1  0
 24 25  1  0
 25 26  1  1
 25 27  1  0
 27 28  1  6
 29 28  1  6
 29 30  1  0
 30 31  1  0
 31 32  1  1
 31 33  1  0
 33 34  1  6
 33 35  1  0
 35 36  1  1
 36 37  1  0
 35 38  1  0
 27 39  1  0
 39 40  1  1
 40 41  1  0
 39 42  1  0
 21 43  1  0
 43 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  1
 50 51  1  0
 51 52  1  1
 51 53  1  0
 53 54  2  0
 55 54  1  6
 55 56  1  0
 56 57  1  6
 55 58  1  0
 58 59  2  0
 53 60  1  0
 43 61  1  6
 16 62  1  0
 58  1  1  0
 62  2  1  0
 13  4  1  0
 42 23  1  0
 56 47  1  0
 38 29  1  0
 56 50  1  0
M  END
