HM0181
     RDKit          3D

116127  0  0  1  0  0  0  0  0999 V2000
   -9.0560    2.8735    2.1745 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.9664    2.5629    3.1604 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.6885    3.2635    2.0967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2705   -1.3554    5.5349 C   0  0  0  0  0  1  0  0  0  0  0  0
   -9.5147    1.4154    2.2244 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.5768    1.5722    4.0935 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.4429    1.9449    4.9921 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3353    1.2861    1.9896 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.3278    1.5240    4.3403 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.0613   -2.9581    3.8832 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.8901    0.1997    0.9615 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.0079   -2.6244    2.3907 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0690   -2.1350    1.5304 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.5568   -4.3809    4.3442 C   0  0  0  0  0  1  0  0  0  0  0  0
  -10.0325   -1.0527    2.6144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1728    1.9136    3.4862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8754    2.2815    4.3342 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.8272    0.7644    2.6234 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.8642   -0.7858   -0.2026 C   0  0  0  0  0  2  0  0  0  0  0  0
  -10.6253   -1.2697    1.2148 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.1370   -0.4683    0.1613 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.4091    3.1588    2.5295 C   0  0  0  0  0  1  0  0  0  0  0  0
   -0.4509   -1.3644    1.9915 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8611   -0.7855    1.8313 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2801   -0.4675    1.9464 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.8055   -0.2498    1.6134 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9596    1.8143   -2.0806 C   0  0  0  0  0  3  0  0  0  0  0  0
    9.2328   -1.7421   -1.1886 C   0  0  0  0  0  3  0  0  0  0  0  0
   10.6499   -3.6103   -1.2438 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2698   -1.9803   -3.1109 C   0  0  0  0  0  2  0  0  0  0  0  0
   17.7976    0.5862   -2.1171 C   0  0  0  0  0  2  0  0  0  0  0  0
   19.2223    1.6759   -0.4801 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7879   -1.1794    1.3666 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5265   -0.3737    1.8087 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.1284    0.1787    0.8143 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.9436    2.5833   -1.5220 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.6754    0.7303   -2.9213 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2634   -1.4668   -2.7039 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0287   -2.9958   -1.5252 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.0370   -3.3988   -2.8240 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5284   -0.4940   -2.9661 C   0  0  0  0  0  2  0  0  0  0  0  0
   16.2930    0.6004   -2.4135 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.0774   -0.6963   -2.8120 C   0  0  0  0  0  1  0  0  0  0  0  0
  -12.1300   -2.3789   -0.1571 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7967   -0.3472    0.6137 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1249    0.1594   -0.5665 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9473    0.4121    0.3004 C   0  0  0  0  0  3  0  0  0  0  0  0
   20.6287    1.4722   -0.0256 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.9236    1.4271    1.9447 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.5238   -1.9633   -0.5970 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.6468    2.2279   -1.8959 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4147    0.6067   -3.4658 C   0  0  0  0  0  3  0  0  0  0  0  0
  -12.8680   -1.1409   -0.5148 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.0045    0.5358   -0.9879 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6472    0.1441   -0.9008 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3960   -1.3405   -0.2613 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1220   -0.0498   -1.6533 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1445    0.4266   -0.7799 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.7838    2.0968    0.8490 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.7263    1.9665   -0.8254 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.4016    1.4161   -3.0134 C   0  0  0  0  0  3  0  0  0  0  0  0
   12.3735   -0.4015   -0.6965 C   0  0  0  0  0  1  0  0  0  0  0  0
  -16.0941   -1.5605   -5.1666 C   0  0  0  0  0  2  0  0  0  0  0  0
   13.5040   -2.3226    0.6197 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.3866   -2.7803   -0.6490 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.5456    1.6298   -1.6357 C   0  0  0  0  0  3  0  0  0  0  0  0
  -14.5630   -1.0911   -2.2028 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6881    0.7706   -1.0881 C   0  0  0  0  0  1  0  0  0  0  0  0
  -14.8431   -0.8926   -3.6529 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.3694   -0.2274    0.4846 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.2496   -0.9094   -1.7118 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.0923   -1.6469   -1.4348 C   0  0  0  0  0  3  0  0  0  0  0  0
  -14.4831   -0.4583    1.3557 C   0  0  0  0  0  2  0  0  0  0  0  0
  -16.6464   -0.1645   -5.0755 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.6221   -3.6078   -1.7114 C   0  0  0  0  0  1  0  0  0  0  0  0
  -15.7295    0.2472   -4.0532 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.2151    1.1984    0.4051 C   0  0  0  0  0  2  0  0  0  0  0  0
  -14.9539    0.8571    2.0241 C   0  0  0  0  0  2  0  0  0  0  0  0
  -14.1420    1.9971    1.3394 C   0  0  0  0  0  2  0  0  0  0  0  0
  -15.9919    1.4335   -3.2412 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.9732    2.3201   -2.9030 C   0  0  0  0  0  3  0  0  0  0  0  0
  -17.2600    1.5756   -2.6514 C   0  0  0  0  0  3  0  0  0  0  0  0
  -15.2426    3.3773   -2.0403 C   0  0  0  0  0  3  0  0  0  0  0  0
  -17.5063    2.6108   -1.7634 C   0  0  0  0  0  3  0  0  0  0  0  0
  -16.5074    3.5324   -1.4895 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.6813    3.9079    2.4830 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0104    3.7939    0.9087 N   0  0  0  0  0  1  0  0  0  0  0  0
   -6.2568    3.0992    5.3769 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6544   -1.9211    4.6231 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1767    2.2168    2.7643 N   0  0  0  0  0  2  0  0  0  0  0  0
   -9.3047    0.1970    2.8264 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1914    0.3285    4.0601 N   0  0  0  0  0  2  0  0  0  0  0  0
   -5.4612    1.0342    4.8671 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0938   -3.0544    1.7179 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2505   -1.9087    3.4973 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4719   -4.8437   -1.3434 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.4830    2.6192   -0.1759 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6224   -0.2178   -3.0934 N   0  0  0  0  0  2  0  0  0  0  0  0
   12.8203   -3.7707   -2.3522 N   0  0  0  0  0  2  0  0  0  0  0  0
  -12.2185   -3.3875   -0.8685 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9721    0.6743   -2.4931 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9339   -0.0100    2.4025 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7703   -2.8493   -0.5939 N   0  0  0  0  0  2  0  0  0  0  0  0
  -11.4027   -2.3539    0.9707 N   0  0  0  0  0  2  0  0  0  0  0  0
   -7.9053   -0.3329   -0.4366 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.9783    0.7217   -1.4704 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1987   -1.8569    0.2138 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6779    1.3142   -0.0608 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.9917   -2.3675   -3.5044 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.2129   -0.9926   -1.8563 N   0  0  0  0  0  0  0  0  0  0  0  0
  -15.1021   -2.0562   -4.4320 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9816   -4.1843   -3.0476 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2525    1.6510   -1.3950 S   0  0  0  0  0  0  0  0  0  0  0  0
   20.3522   -0.9138   -2.4843 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.5500   -1.2920   -1.4819 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.2707    1.8285    1.3124 C   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  1  0
  1  5  1  0
  3 86  2  0
  3 87  1  0
  3 90  1  0
  4 89  1  0
  5 91  1  0
  6  2  1  0
  6 92  1  0
  6  7  1  0
  7 88  2  0
  7 93  1  0
  8 11  1  0
  8 90  1  0
  9 16  1  0
  9 93  1  0
 10 12  1  0
 10 14  1  0
 10 89  1  0
 11 19  1  0
 12 23  2  0
 12 94  1  0
 13 24  1  0
 13 94  2  0
 15 20  1  0
 15 91  1  0
 15 95  2  0
 16 17  1  0
 16 18  1  0
 16 22  1  0
 18 26  1  0
 20 21  1  0
 21 46  1  0
 23 33  1  0
 23 34  1  0
 24 34  2  0
 24102  1  0
 25 35  1  0
 25102  1  0
 26 33  2  0
 26 45  1  0
 27 36  2  0
 27 37  1  0
 28 19  1  0
 28 38  1  0
 28103  1  0
 29 96  2  0
 29103  1  0
 30 40  1  0
 30 41  1  0
 31 42  1  0
 31106  1  0
 32 48  1  0
 32 97  2  0
 32106  1  0
 33107  1  0
 35108  1  0
 36 51  1  0
 37 52  2  0
 37 98  1  0
 38 98  1  0
 38109  2  0
 39 29  1  0
 39 99  1  0
 39 50  1  0
 40 99  1  0
 40112  2  0
 41101  1  0
 42101  1  0
 43110  1  0
 44100  2  0
 44104  1  0
 45 47  2  0
 45 56  1  0
 46105  2  0
 46113  1  0
 47 55  1  0
 48 58  1  0
 49 59  1  0
 49102  1  0
 50 62  1  0
 50 64  1  0
 51 60  1  0
 51 61  2  0
 52 61  1  0
 53 44  1  0
 53 70  1  0
 53110  1  0
 54 55  1  0
 54 66  2  0
 54105  1  0
 55 71  2  0
 56 72  2  0
 56107  1  0
 57 58  1  0
 57106  1  0
 57114  2  0
 59108  1  0
 60108  1  0
 63 74  1  0
 63111  1  0
 65 75  1  0
 65107  1  0
 66113  1  0
 67110  1  0
 67115  2  0
 68108  1  0
 69 76  1  0
 69111  1  0
 69 67  1  0
 70 73  1  0
 70 77  1  0
 71 72  1  0
 73 78  1  0
 74 76  1  0
 76 80  1  0
 77 79  1  0
 78 79  1  0
 80 81  2  0
 80 82  1  0
 81 83  1  0
 82 84  2  0
 83 85  2  0
 84 85  1  0
 91 92  1  0
104 20  1  0
116 48  1  0
M  RAD  8   1   3   2   3   4   2   5   3   6   2   8   3   9   3  10   2
M  RAD  8  11   3  13   2  14   2  17   2  18   3  19   3  20   2  21   3
M  RAD  8  22   2  25   3  27   2  28   2  30   3  31   3  34   2  35   3
M  RAD  8  36   2  39   2  41   3  42   3  43   2  47   2  48   2  49   3
M  RAD  8  50   2  52   2  53   2  58   3  59   3  60   3  61   2  62   2
M  RAD  8  63   3  64   2  65   3  66   2  68   2  69   2  70   2  71   2
M  RAD  8  72   2  73   3  74   3  75   2  76   2  77   3  78   3  79   3
M  RAD  8  81   2  82   2  83   2  84   2  85   2  87   3  90   2  92   2
M  CHG  1 108   1
M  RAD  5  98   2  99   2 103   2 104   2 116   2
M  END
$$$$
