C4390.sdf
  ChemDraw04181714502D

103109  0  0  0  0  0  0  0  0999 V2000
    5.9070   -3.6144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8580   -2.7909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1203   -2.4216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0712   -1.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3335   -1.2287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2844   -0.4052    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9731    0.0490    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7108   -0.3202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7599   -1.1438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3825   -2.0523    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6448   -1.6830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6938   -2.5065    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9258   -2.8077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4020   -2.1702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5785   -2.2193    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2092   -2.9570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1242   -1.5306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3007   -1.5797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1536   -0.8910    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2157   -0.1532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9771   -0.9400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3464   -1.6778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7157   -2.4155    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8921   -2.3664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1699   -1.7268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4313   -0.2513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2549   -0.3004    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6993   -0.9955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4977   -0.7876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1351   -1.3114    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0002   -2.1253    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6376   -2.6490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5028   -3.4629    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1402   -3.9867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0053   -4.8006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6428   -5.3243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4151   -5.0342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0525   -5.5579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9176   -6.3718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5499   -4.2203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9125   -3.6965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0474   -2.8826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4099   -2.3589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5448   -1.5450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2279   -2.4154    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5467    0.0359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2844    0.4052    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3335    1.2287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0712    1.5980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1203    2.4216    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8580    2.7909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5467    2.3366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9070    3.6144    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7599    1.1438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7108    0.3202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9731   -0.0490    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3825    2.0523    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6448    1.6830    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6938    2.5065    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9258    2.8077    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4020    2.1702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5785    2.2193    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2092    2.9570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1242    1.5306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3007    1.5797    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1536    0.8910    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2157    0.1532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9771    0.9400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3464    1.6778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7157    2.4155    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8921    2.3664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1699    1.7268    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4313    0.2513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2549    0.3004    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6993    0.9955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4977    0.7876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1351    1.3114    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0002    2.1253    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6376    2.6490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5028    3.4629    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.1402    3.9867    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0053    4.8006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6428    5.3243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4151    5.0342    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0525    5.5579    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9176    6.3718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5499    4.2203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9125    3.6965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0474    2.8826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4099    2.3589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5448    1.5450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2279    2.4154    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5467   -0.0359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8580   -0.4902    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0620   -0.4864    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0686    2.3174    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4967    1.3507    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0779    1.0836    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8580    0.4902    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0620    0.4864    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0686   -2.3174    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4967   -1.3507    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0779   -1.0836    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0      
  2  3  1  0      
  4  3  1  6      
  4  5  1  0      
  5  6  1  0      
  6  7  1  0      
  7  8  2  0      
  8  9  1  0      
  4  9  1  0      
  5 10  1  6      
  5 11  1  0      
 11 12  1  0      
 12 13  1  0      
 13 14  1  0      
 14 15  1  0      
 15 16  1  0      
 15 17  1  0      
 17 18  1  0      
 18 19  1  0      
 19 20  1  0      
 19 21  1  0      
 21 22  1  1      
 22 23  1  0      
 22 24  1  0      
 22 25  1  0      
 21 26  1  0      
 26 27  1  0      
 27 28  1  0      
 28 29  1  0      
 29 30  1  1      
 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  2  0      
 37 38  1  0      
 38 39  1  0      
 37 40  1  0      
 40 41  2  0      
 34 41  1  0      
 41 42  1  0      
 42 43  2  0      
 32 43  1  0      
 43 44  1  0      
 31 45  2  0      
 29 46  1  0      
 46 47  1  0      
 47 48  1  0      
 48 49  1  0      
 49 50  1  6      
 50 51  1  0      
 51 52  1  0      
 51 53  2  0      
 49 54  1  0      
 54 55  1  0      
 55 56  2  0      
 47 56  1  0      
 48 57  1  6      
 48 58  1  0      
 58 59  1  0      
 59 60  1  0      
 60 61  1  0      
 61 62  1  0      
 62 63  1  0      
 62 64  1  0      
 64 65  1  0      
 65 66  1  0      
 66 67  1  0      
 66 68  1  0      
 68 69  1  1      
 69 70  1  0      
 69 71  1  0      
 69 72  1  0      
 68 73  1  0      
 73 74  1  0      
 74 75  1  0      
 75 76  1  0      
 76 77  1  1      
 77 78  1  0      
 78 79  1  0      
 79 80  2  0      
 80 81  1  0      
 81 82  1  0      
 82 83  2  0      
 83 84  1  0      
 84 85  1  0      
 85 86  1  0      
 84 87  2  0      
 81 88  2  0      
 87 88  1  0      
 88 89  1  0      
 89 90  2  0      
 79 90  1  0      
 90 91  1  0      
 78 92  2  0      
 76 93  1  0      
  6 93  1  0      
 93 94  2  0      
 73 95  2  0      
 65 96  2  0      
 61 97  2  0      
 58 98  2  0      
 46 99  2  0      
 26100  2  0      
 18101  2  0      
 14102  2  0      
 11103  2  0      
M  END
$$$$
