DRG07206
     RDKit          3D

123126  0  0  1  0  0  0  0  0999 V2000
   18.3996    0.6354   -0.8046 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5179   -0.4667   -1.6590 C   0  0  0  0  0  3  0  0  0  0  0  0
   19.1941   -1.6211   -1.2458 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7514   -1.6683    0.0381 C   0  0  0  0  0  3  0  0  0  0  0  0
   19.6574   -0.5685    0.8948 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9846    0.5822    0.4641 C   0  0  0  0  0  3  0  0  0  0  0  0
   17.7138    1.8574   -1.2596 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8370    2.2276   -2.4583 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9214    2.6532   -0.3685 N   0  0  0  0  0  2  0  0  0  0  0  0
   16.3636    2.1568    0.8817 C   0  0  0  0  0  2  0  0  0  0  0  0
   15.1868    1.2913    0.5912 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1671   -0.0891    0.6172 C   0  0  0  0  0  3  0  0  0  0  0  0
   13.9364   -0.4154    0.1828 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.2569    0.6851   -0.0983 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.0046    1.7518    0.1404 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.2907   -0.6209    2.1751 N   0  0  0  0  0  2  0  0  0  0  0  0
   20.4834    0.7589    3.2052 S   0  0  0  0  0  0  0  0  0  0  0  0
   21.5251    1.6682    2.6119 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.1756    1.4900    3.3332 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.9862    0.2009    4.8195 C   0  0  0  0  0  2  0  0  0  0  0  0
   21.9081    1.5135    5.6909 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0 15  0  0  0  0  0  0
   19.3536   -2.7452   -2.1181 N   0  0  0  0  0  2  0  0  0  0  0  0
   18.7371   -2.8298   -3.7372 S   0  0  0  0  0  0  0  0  0  0  0  0
   17.3007   -2.3858   -3.7632 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.8066   -4.2609   -4.1953 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.7305   -1.8482   -4.8546 C   0  0  0  0  0  2  0  0  0  0  0  0
   19.5574   -0.3546   -4.6177 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.3508   -1.4193    0.2327 C   0  0  0  0  0  1  0  0  0  0  0  0
  -13.4201    2.6596    1.8623 C   0  0  0  0  0  1  0  0  0  0  0  0
   -5.3227   -0.6001   -1.8856 C   0  0  0  0  0  1  0  0  0  0  0  0
  -11.6778    2.3071    3.6647 C   0  0  0  0  0  2  0  0  0  0  0  0
  -18.0699   -2.2425    2.7529 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.0972    2.0001    2.2310 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.6041   -0.8301   -0.4103 C   0  0  0  0  0  3  0  0  0  0  0  0
  -12.5902    1.6470    4.6917 C   0  0  0  0  0  1  0  0  0  0  0  0
  -17.3965   -2.1400    1.3951 C   0  0  0  0  0  2  0  0  0  0  0  0
  -17.2064   -1.4636    3.7329 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.0025    0.4852    0.2802 C   0  0  0  0  0  3  0  0  0  0  0  0
  -11.9935    0.5009    1.9022 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.1742    3.2904    2.1296 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.6180    3.0534    2.5949 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.3627    1.3103    2.5497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8854   -0.5244    1.0342 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.1828   -0.0275    0.6999 C   0  0  0  0  0  2  0  0  0  0  0  0
  -16.2131   -0.6694    2.9015 C   0  0  0  0  0  3  0  0  0  0  0  0
  -15.3189   -0.9985    0.5347 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0525    2.7701    1.7005 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.3114    2.4780    2.1498 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1965    1.1772   -0.3225 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8467   -0.7669   -0.0317 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.2708   -0.3611    1.8881 C   0  0  0  0  0  3  0  0  0  0  0  0
  -18.7831    1.1780    3.9621 C   0  0  0  0  0  1  0  0  0  0  0  0
  -16.4360    0.8602    2.9647 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.2043   -0.6843   -3.3081 C   0  0  0  0  0  1  0  0  0  0  0  0
    2.5704    1.0192   -4.0633 C   0  0  0  0  0  1  0  0  0  0  0  0
    0.1487    1.4362    1.2859 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2058    1.1293    1.7843 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.7781   -0.7371    2.3701 C   0  0  0  0  0  1  0  0  0  0  0  0
   -9.3935   -1.7040   -1.1178 C   0  0  0  0  0  3  0  0  0  0  0  0
  -11.3977    0.7563   -0.5404 C   0  0  0  0  0  1  0  0  0  0  0  0
  -17.8421    1.4655    2.7946 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.3021    0.4497   -2.8645 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.9852    0.6141    1.3506 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.6974   -3.0755   -0.5366 C   0  0  0  0  0  1  0  0  0  0  0  0
   -8.4038   -1.8649   -2.2545 C   0  0  0  0  0  1  0  0  0  0  0  0
  -13.2312   -2.1833    3.1486 C   0  0  0  0  0  1  0  0  0  0  0  0
  -18.4507    1.1590    1.4625 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5838   -0.2384    0.0135 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4270   -1.7660    0.0104 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.2936   -1.0021    2.2344 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.5627   -0.2188    1.1124 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.4532    1.5806   -3.0581 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0389    1.5621   -2.1055 C   0  0  0  0  0  3  0  0  0  0  0  0
  -15.9579    1.1153    5.1865 C   0  0  0  0  0  1  0  0  0  0  0  0
   12.4501   -2.1111    1.1211 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.8049   -1.1311    2.2326 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.3922   -0.5016   -0.3694 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.9014    0.3491   -2.3357 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.3918    1.3346   -0.6498 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9595   -0.7829   -0.2516 C   0  0  0  0  0  3  0  0  0  0  0  0
  -18.4105    1.5987   -1.0691 C   0  0  0  0  0  3  0  0  0  0  0  0
  -18.2759    0.1768   -1.6297 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.2019   -2.0730    0.5259 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.8426   -3.6846   -1.3759 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.1836   -3.3317   -3.7875 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.8271    2.1538   -1.1415 C   0  0  0  0  0  1  0  0  0  0  0  0
    2.3785   -3.2424   -0.0010 C   0  0  0  0  0  2  0  0  0  0  0  0
  -18.3387    0.1543   -3.1240 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.5458    0.3812   -3.8016 C   0  0  0  0  0  3  0  0  0  0  0  0
  -17.1787   -0.1246   -3.8567 C   0  0  0  0  0  3  0  0  0  0  0  0
  -19.5889    0.3454   -5.1976 C   0  0  0  0  0  3  0  0  0  0  0  0
  -17.2220   -0.1623   -5.2532 C   0  0  0  0  0  3  0  0  0  0  0  0
  -18.4255    0.0734   -5.9247 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.2903    1.1444    3.7979 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6934   -1.0256    2.1752 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4324    0.5110   -0.6031 N   0  0  0  0  0  2  0  0  0  0  0  0
  -16.3302   -1.1719    1.5448 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7004    2.3864    1.9518 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0929    0.3825    1.7372 N   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0866    0.2329    0.7851 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0861    2.3942   -0.6309 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.9146   -1.7154    1.8732 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.3772   -1.6702   -0.5288 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2545    2.1444   -3.8459 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4081    0.9383    0.8147 N   0  0  0  0  0  2  0  0  0  0  0  0
  -15.6183    1.5389    3.8915 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9875    0.1860    0.1098 N   0  0  0  0  0  2  0  0  0  0  0  0
   11.2563   -1.4080    0.9389 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4283    0.6903   -1.0926 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.8615    1.7169    0.2823 N   0  0  0  0  0  2  0  0  0  0  0  0
  -19.4734    0.4243    1.3830 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1479    2.1447   -2.8692 N   0  0  0  0  0  2  0  0  0  0  0  0
    8.9002    0.0458    1.3961 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5884   -0.8153   -0.5056 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0595   -4.1491   -4.1810 O   0  0  0  0  0  0  0  0  0  0  0  0
  -19.2279   -0.6922   -1.0908 O   0  0  0  0  0  1  0  0  0  0  0  0
    5.0675    2.2202   -0.0620 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0226   -3.0499   -2.3980 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.3456   -2.6863   -4.7388 N   0  0  0  0  0  1  0  0  0  0  0  0
   18.0202    0.2498   -5.3795 S   0  0  0  0  0  0  0  0  0  0  0  0
   18.8242    0.5307   -6.9818 C   0  0  0  0  0  1  0  0  0  0  0  0
   23.4706    0.6015    5.5398 C   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  2  0
  1  7  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  5 16  1  0
  6  1  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  1  0
 14 15  2  0
 15 11  1  0
 16 17  1  0
 17 18  2  0
 17 19  2  0
 17 20  1  0
 20 21  1  0
 21123  1  0
 23 24  1  0
 23  3  1  0
 24 25  2  0
 24 26  2  0
 24 27  1  0
 27 28  1  0
 28121  1  0
 29 35  1  0
 31 35  1  0
 32 34  1  0
 32 36  1  0
 33 37  1  0
 33 38  1  0
 34 30  1  0
 34 40  1  0
 37 98  1  0
 39 35  1  0
 39 50  1  0
 39100  1  0
 40 52  1  0
 40101  1  0
 41 48  2  0
 41 49  1  0
 42 49  1  0
 42 99  1  0
 43 95  2  0
 43 99  1  0
 43100  1  0
 44 96  2  0
 44101  1  0
 45 47  1  0
 46 38  1  0
 46 54  1  0
 46 98  1  0
 47 98  1  0
 47104  2  0
 48 57  1  0
 49 58  2  0
 50 97  1  0
 50102  2  0
 51 44  1  0
 51 60  1  0
 51 97  1  0
 52 45  1  0
 52103  1  0
 54 62  1  0
 54107  1  0
 55 63  1  0
 56 63  1  0
 57 64  2  0
 57106  1  0
 58 64  1  0
 59100  1  0
 60 65  1  0
 60 66  1  0
 61101  1  0
 62 53  1  0
 62 68  1  0
 67103  1  0
 68111  1  0
 68112  2  0
 69106  1  0
 69115  2  0
 70 76  1  0
 70 13  1  0
 71 77  1  0
 71114  1  0
 72 78  1  0
 72114  1  0
 73 79  1  0
 73105  2  0
 73113  1  0
 74 63  1  0
 74 80  1  0
 74113  1  0
 75107  1  0
 76109  1  0
 77109  1  0
 78110  1  0
 79110  1  0
 80108  1  0
 80118  2  0
 81 69  1  0
 81 84  1  0
 81108  1  0
 82 83  1  0
 82 87  1  0
 82111  1  0
 83 89  1  0
 83117  1  0
 84 88  1  0
 85 88  1  0
 85119  1  0
 86116  2  0
 86119  1  0
 86120  1  0
 89 90  2  0
 89 91  1  0
 90 92  1  0
 91 93  2  0
 92 94  2  0
 93 94  1  0
121122  1  0
M  RAD  8   2   2   4   2   6   2   9   2  10   3  12   2  16   2  20   3
M  RAD  8  23   2  27   3  28   3  29   2  30   2  31   2  32   3  33   3
M  RAD  8  34   2  35   2  36   2  37   3  38   3  39   2  40   2  41   2
M  RAD  8  42   3  45   3  46   2  48   2  51   2  52   2  53   2  54   2
M  RAD  8  55   2  56   2  58   2  59   2  60   2  61   2  62   2  63   2
M  RAD  8  64   2  65   2  66   2  67   2  70   3  71   3  72   3  74   2
M  RAD  8  75   2  76   3  77   3  78   3  79   3  81   2  82   2  83   2
M  RAD  8  84   3  85   3  87   2  88   3  90   2  91   2  92   2  93   2
M  RAD  8  94   2  97   2 106   2 108   2 111   2 113   2 117   2 119   2
M  RAD  3 120   3 122   2 123   2
M  END
$$$$
