DRG07428
     RDKit          3D

124130  0  0  1  0  0  0  0  0999 V2000
    1.3402   -2.6856    7.8155 C   0  0  0  0  0  1  0  0  0  0  0  0
    3.5878    0.3962    8.6564 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.3755   -6.7144    1.8222 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.8257   -0.5132    5.1003 C   0  0  0  0  0  1  0  0  0  0  0  0
   -0.5915   -1.2849    3.9468 C   0  0  0  0  0  1  0  0  0  0  0  0
    4.2323   -0.8602    7.9410 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.1551   -4.4098    0.3899 C   0  0  0  0  0  1  0  0  0  0  0  0
   -7.5877   -2.6357    5.4448 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.1454   -1.4585    4.0433 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.3343   -1.7305    7.1834 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.6066   -1.4343    8.3225 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4733    0.1928    6.9264 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.3156    0.1033    8.4117 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.8301    1.1699    4.6758 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.0870   -4.1751    5.1407 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4569   -4.8957    2.8906 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.7754   -2.6793    3.5093 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.6755   -4.0165    3.4999 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8387   -2.6237    6.0760 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.6806    1.1378    6.0702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0140   -4.8723    2.8023 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.4296   -2.9545    2.0901 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1846   -4.4823    4.0413 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.0387   -3.9550    4.0803 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.5939   -1.6819    3.2491 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0233    2.0038    3.8910 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.0682    1.1063    9.3893 C   0  0  0  0  0  1  0  0  0  0  0  0
    4.6529   -1.8648    5.0994 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.7866    2.0320    6.6608 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.1080   -2.2541    3.9585 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.8285   -5.9804    3.3072 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.5741   -5.1928    4.6059 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.0944    2.8411    4.5058 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.3792   -1.4498    3.6536 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.9869    2.8871    5.9021 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.4469   -6.9184    2.4279 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.6397   -6.4769    4.7901 C   0  0  0  0  0  1  0  0  0  0  0  0
   -6.0322   -5.8997    5.9014 C   0  0  0  0  0  1  0  0  0  0  0  0
   -7.9426   -5.7670    4.0646 C   0  0  0  0  0  1  0  0  0  0  0  0
   -3.0666   -8.0343    1.5126 C   0  0  0  0  0  1  0  0  0  0  0  0
    8.4371   -0.5075    6.4799 O   0  0  0  0  0  1  0  0  0  0  0  0
    6.3700   -0.6467    9.0901 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.9805   -1.5066    7.4022 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2190   -5.0323    6.0014 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1827   -5.3042    1.7858 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4238   -4.8265    2.6021 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2739   -3.5604    6.4350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5996   -4.0821    1.7957 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7045   -2.7360    4.2241 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0243   -2.0745    2.0729 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8627   -2.6226    8.1029 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7659   -2.9753    5.0744 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8467   -3.2264    4.1698 N   0  0  0  0  0  2  0  0  0  0  0  0
   -7.0757   -0.5557    3.4573 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8077   -2.1178    1.2512 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3525   -6.1107   -2.5344 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.6759   -5.7928   -2.6837 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.5583   -5.1394   -2.9239 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.0095   -4.5021   -3.1113 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.2667   -3.8568   -3.4405 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6228    6.2415   -5.0500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5617    6.8040   -3.8109 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.5773    4.4114   -3.5420 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.4874    3.5493   -3.0551 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.8148   -0.4527   -1.5309 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.7855   -1.7839   -3.2126 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.8118   -3.0302   -5.7958 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.7356   -3.6927   -3.7614 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0951   -3.4750   -3.5183 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5561    6.6192   -6.0758 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.2704    7.8360   -4.5380 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2426    5.7211   -3.0535 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.1422    4.6549   -3.0055 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.3359    2.9274   -1.9019 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.9758    1.0307   -1.1790 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.9584   -1.8664   -4.7528 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.9106   -2.7708   -6.6886 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7256   -3.2764   -4.7334 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.8544   -2.2993   -4.0367 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8098    6.2801   -7.4781 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.1967   -1.9700   -4.5506 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.6112   -1.1205   -4.7642 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7102    5.1336   -8.0697 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.1214    7.0265   -8.7129 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.9244   -0.7808   -5.1981 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8575   -0.7297   -5.1437 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4630   -0.3104   -5.2224 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9174    0.0692   -5.5767 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.6807    0.9705   -5.7960 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.6756    1.3175   -6.1444 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.3670    1.7716   -6.2472 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.3633    7.1313   -4.6184 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0705   -4.5143   -2.9199 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5715    7.5562   -5.8101 N   0  0  0  0  0  2  0  0  0  0  0  0
    6.9189   -2.0168   -6.2200 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.9543    4.7647   -2.4382 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0922    2.3328   -0.9789 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4374   -3.1451   -3.9263 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5731    4.9469   -4.7235 N   0  0  0  0  0  2  0  0  0  0  0  0
    4.7655    4.0844   -4.0282 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5581   -1.7088   -1.8952 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3255    8.9603   -4.0087 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8806   -3.2984   -7.8046 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8419   -1.1155    1.1618 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.5410   -0.0930    0.1915 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8950   -0.2421   -1.1465 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.5079    0.7221   -2.0817 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.7719    1.8650   -1.7348 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4601    1.9783   -0.3636 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.8050    1.0215    0.5847 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.3845    2.8633   -2.5571 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.6306    2.8458   -3.8781 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7386    4.2581   -4.4553 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.7776    1.8741   -4.6274 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0334    4.7089   -4.9036 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.4697    5.1829   -5.3633 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.8927    5.6421   -5.8061 C   0  0  0  0  0  2  0  0  0  0  0  0
  -10.2273    6.0347   -6.2873 N   0  0  0  0  0  2  0  0  0  0  0  0
  -11.2780    5.6687   -5.5573 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1155    5.0118   -4.2437 N   0  0  0  0  0  1  0  0  0  0  0  0
  -12.4525    5.7998   -5.9064 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2349   -2.3764   -3.8113 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8590   -1.4646   -4.5223 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1522   -0.5975   -6.6731 C   0  0  0  0  0  1  0  0  0  0  0  0
  1 43  1  0
  3 45  1  0
  4  9  1  0
  5  9  1  0
  6  2  1  0
  6 10  1  0
  6 11  1  0
  7 48  1  0
  8 49  1  0
 10 19  1  0
 10 43  1  0
 11 42  1  0
 11 51  2  0
 12 13  1  0
 12 20  1  0
 12 41  1  0
 13 27  1  0
 13 42  1  0
 14 20  2  0
 14 26  1  0
 15 23  1  0
 15 44  2  0
 15 52  1  0
 16 21  1  0
 16 23  1  0
 16 45  1  0
 17  9  1  0
 17 22  1  0
 17 53  1  0
 18 46  2  0
 18 53  1  0
 19 28  1  0
 19 47  1  1
 19 52  1  0
 20 29  1  0
 21 31  1  0
 21 48  1  0
 22 48  1  0
 22 55  2  0
 24 18  1  0
 24 32  1  0
 24 49  1  0
 25 49  1  0
 25 50  1  0
 25 54  2  0
 26 33  2  0
 28 34  1  0
 29 35  2  0
 30 34  1  0
 30 52  1  0
 31 36  1  0
 31 37  1  0
 32 38  1  0
 32 39  1  0
 33 35  1  0
 36 40  1  0
 50104  1  0
 56 57  2  0
 56 58  1  0
 57 59  1  0
 58 60  2  0
 59 69  2  0
 60 69  1  0
 60 98  1  0
 61 92  2  0
 61 99  1  0
 62 71  1  0
 62 72  1  0
 63 73  1  0
 63100  1  0
 64 74  1  0
 64100  1  0
 65 75  1  0
 65101  1  0
 66 76  1  0
 66101  1  0
 67 77  1  0
 67 78  1  0
 68 78  1  0
 68 93  2  0
 68 98  1  0
 69 79  1  0
 70 61  1  0
 70 80  1  0
 70 94  1  0
 71 94  1  0
 71102  2  0
 72 96  1  0
 73 96  1  0
 74 97  1  0
 75 97  1  0
 76 95  1  0
 77 95  1  0
 77103  2  0
 79 82  2  0
 79122  1  0
 80 83  1  0
 80 84  1  0
 81 86  1  0
 81 98  1  0
 82 85  1  0
 82 87  1  0
 85123  1  0
 85124  1  0
 86 87  2  0
 86 88  1  0
 87 89  1  0
 88 90  2  0
 89 91  2  0
 90 91  1  0
104105  1  0
105106  2  0
106107  1  0
107108  2  0
108109  1  0
108111  1  0
109110  2  0
110105  1  0
111112  1  0
112113  1  0
112114  2  0
113 99  1  0
113115  1  0
115116  1  0
116117  1  0
117118  1  0
118119  1  0
119120  1  0
119121  2  0
122123  2  0
M  RAD  8   1   2   2   2   3   2   4   2   5   2   6   2   7   2   8   2
M  RAD  8   9   2  10   2  12   2  13   2  14   2  16   2  17   2  21   2
M  RAD  8  23   3  24   2  26   2  27   2  28   3  29   2  30   3  31   2
M  RAD  8  32   2  33   2  34   3  35   2  36   3  37   2  38   2  39   2
M  RAD  8  40   2  41   2  42   2  53   2  56   2  57   2  58   2  59   2
M  RAD  8  62   3  63   3  64   3  65   3  66   3  67   3  70   2  72   3
M  RAD  8  73   3  74   3  75   3  76   3  78   3  80   2  81   3  83   2
M  RAD  8  84   2  88   2  89   2  90   2  91   2  94   2  95   2  99   2
M  RAD  8 104   3 106   2 107   2 109   2 110   2 111   2 113   2 115   3
M  RAD  5 116   3 117   3 118   2 120   3 124   2
M  END
$$$$
