18DRG0LUQSH.sdf
  ChemDraw03142516012D

106114  0  0  1  0  0  0  0  0999 V2000
   11.6260    3.4414    0.0000 O   0  0  0  0  0  2  0  0  0  0  0  0
   10.8361    3.2033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0501    3.5461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0057    4.3671    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7202    4.7796    0.0000 O   0  0  0  0  0  2  0  0  0  0  0  0
    9.2189    4.7123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2980    5.5355    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5136    5.8746    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3163    4.2238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6019    4.6363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2190    4.2066    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3872    3.3941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0490    3.0487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5383    3.4274    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2238    2.2944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8397    1.7455    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4811    1.8020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6459    1.0542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4102    0.7436    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9023    0.5651    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2431    0.9106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5019    0.4244    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8413    0.7756    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2235    0.3564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4317    0.6974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7172    0.2849    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9643    0.6929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3083    0.2664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2816   -0.4975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5671   -0.9100    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.8526   -0.4975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1382   -0.9100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5147   -0.5315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2834   -0.9247    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2730   -1.7496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9874   -2.1621    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7019   -1.7496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7019   -0.9246    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4164   -2.1621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4164   -2.9871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7019   -3.3996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7019   -4.2246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9874   -4.6371    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9874   -5.4621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2730   -5.8746    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7019   -5.8746    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1309   -1.7496    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8453   -2.1621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8453   -2.9871    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5598   -1.7496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2743   -2.1621    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9887   -1.7496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9887   -0.9246    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7032   -2.1621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4177   -1.7496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1321   -2.1621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8466   -1.7496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5611   -2.1621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.2756   -1.7496    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -11.2660   -0.9627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6199   -0.4497    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.2061   -0.7594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6046   -1.4818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9373   -2.1452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0400   -2.9638    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5598   -0.9246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2743   -0.5121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8453   -0.5121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4981   -2.1277    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1395   -1.6760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1546   -1.6244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9796   -1.6244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0425   -0.9046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6950   -0.5398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3914    1.4577    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0063    1.9321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9008    2.7503    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7962    1.5976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4080    2.0785    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0686    1.7248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8125    2.1543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7692    2.9797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1064    3.4483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3301    3.1689    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9511   -0.2624    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.8560   -0.5239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5016   -0.0102    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8981   -1.2905    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1836   -1.7030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6956   -1.6922    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3105   -1.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2659   -0.4508    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8832   -0.0334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5977   -0.4459    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8385    0.7885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1240    1.2010    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5909    1.2121    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3053    0.7996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5410    2.0307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2057    2.5194    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3668    2.4777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5594    2.6473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7202    5.6046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8147    4.2445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2314    4.8279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6046    4.4826    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1      
  2  3  1  0      
  4  3  1  0      
  4  5  1  6      
  4  6  1  0      
  6  7  2  0      
  7  8  1  0      
  9  8  1  0      
  9 10  1  0      
  9 11  1  6      
 11 12  1  0      
 12 13  2  0      
 13 14  1  0      
 13 15  1  0      
 15 16  1  0      
 15 17  2  0      
 17 18  1  0      
 18 19  2  0      
 18 20  1  0      
 20 21  2  0      
 21 22  1  0      
 22 23  1  0      
 23 24  2  0      
 24 25  1  0      
 25 26  1  0      
 26 27  1  0      
 27 28  1  0      
 28 29  1  0      
 29 30  1  0      
 30 31  1  0      
 31 32  1  0      
 32 33  2  0      
 33 34  1  0      
 34 35  2  0      
 35 36  1  0      
 36 37  1  0      
 37 38  2  0      
 39 37  1  0      
 39 40  1  6      
 40 41  1  0      
 41 42  1  0      
 42 43  1  0      
 43 44  1  0      
 44 45  1  0      
 44 46  2  0      
 39 47  1  0      
 47 48  1  0      
 48 49  2  0      
 50 48  1  0      
 50 51  1  0      
 51 52  1  0      
 52 53  2  0      
 52 54  1  0      
 54 55  1  0      
 55 56  1  0      
 56 57  1  0      
 57 58  1  0      
 58 59  1  0      
 59 60  1  0      
 60 61  2  0      
 60 62  1  0      
 63 62  2  0      
 63 64  1  0      
 64 59  1  0      
 64 65  2  0      
 50 66  1  1      
 66 67  1  0      
 66 68  1  0      
 35 69  1  0      
 69 70  2  0      
 70 32  1  0      
 30 71  1  0      
 30 72  1  0      
 29 73  1  0      
 73 74  1  0      
 74 26  1  0      
 25 75  2  0      
 75 76  1  0      
 76 77  1  0      
 76 78  2  0      
 78 23  1  0      
 78 79  1  0      
 79 80  2  0      
 80 21  1  0      
 80 81  1  0      
 81 17  1  0      
 81 82  2  0      
 82 12  1  0      
 82 83  1  0      
  9 83  1  0      
 83 84  2  0      
 20 85  1  0      
 85 86  1  0      
 86 87  2  0      
 86 88  1  0      
 88 89  1  0      
 88 90  2  0      
 90 91  1  0      
 91 92  2  0      
 93 92  1  0      
 93 94  1  0      
 95 93  1  0      
 95 96  1  6      
 95 97  1  0      
 97 98  1  6      
 97 99  1  0      
 99100  1  6      
 99101  1  0      
101  2  1  0      
101102  1  1      
  5103  1  0      
  1104  1  0      
104105  1  0      
104106  2  0      
M  CHG  1  30   1
M  END
$$$$
