CHH0137
     RDKit          3D

 96101  0  0  1  0  0  0  0  0999 V2000
   15.1823   -3.0854    3.5578 C   0  0  0  0  0  1  0  0  0  0  0  0
   15.3524   -2.1847    2.3187 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.7943   -0.8193   -1.8430 C   0  0  0  0  0  2  0  0  0  0  0  0
   15.6963   -1.3731    1.2011 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2167   -1.1840    1.7224 C   0  0  0  0  0  2  0  0  0  0  0  0
   13.4433   -1.3679    0.2400 C   0  0  0  0  0  3  0  0  0  0  0  0
    9.6162   -0.5264    1.2488 C   0  0  0  0  0  2  0  0  0  0  0  0
   17.0109   -0.9712    1.0204 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7953   -0.9952    0.1871 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5881   -1.0957   -0.8464 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3010    1.2503    2.1270 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7075   -0.6328    1.5133 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5379   -1.1094    0.1306 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.5522    1.1693    0.6884 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.3684   -0.9909   -1.5402 C   0  0  0  0  0  3  0  0  0  0  0  0
   17.3942   -0.2016   -0.0652 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0959    1.4332   -1.1245 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2838    1.5774    0.9923 C   0  0  0  0  0  3  0  0  0  0  0  0
   15.2891   -0.2431   -0.9276 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6226    0.1471    0.6119 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8659   -0.0117    0.0141 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1103   -0.4216   -1.9487 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0053    0.3547    0.7921 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.0745    1.2199    0.1305 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9924    0.6928   -2.0287 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.2582   -0.1548   -2.3428 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4195    0.0473   -1.9458 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.8230   -2.6302    0.4492 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.4892   -1.6367    1.5582 C   0  0  0  0  0  2  0  0  0  0  0  0
   19.7592    0.6183   -0.6941 C   0  0  0  0  0  3  0  0  0  0  0  0
   21.1746    0.7825   -0.5062 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9017    0.2931    2.0329 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3331    0.7218   -3.5739 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.6799   -3.0167   -0.3490 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1277   -2.1948    1.1668 C   0  0  0  0  0  2  0  0  0  0  0  0
   22.1707    1.5458   -1.3579 C   0  0  2  0  0  0  0  0  0  0  0  0
   23.6044    1.9170   -0.6283 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2771    0.6435    1.8707 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.9385   -1.6472    1.5276 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9908   -0.5366    1.5828 C   0  0  0  0  0  3  0  0  0  0  0  0
   21.5820    2.8577   -1.7529 C   0  0  0  0  0  2  0  0  0  0  0  0
   20.9386    4.2553   -2.1039 C   0  0  0  0  0  1  0  0  0  0  0  0
   11.3063   -1.5751   -0.8709 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7038    2.1644    2.8523 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.1658   -1.2282    2.4978 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3361    1.0616    2.2721 C   0  0  0  0  0  1  0  0  0  0  0  0
    6.0103    1.0917    1.1168 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.4946    2.5560   -1.4908 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3438   -0.6454    1.1742 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2573    0.3267   -1.5628 N   0  0  0  0  0  2  0  0  0  0  0  0
    8.6983   -0.0172    2.3091 N   0  0  0  0  0  2  0  0  0  0  0  0
   -7.1173    1.0971    2.5483 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4709    0.7277   -0.0150 N   0  0  0  0  0  2  0  0  0  0  0  0
   16.5665    0.1622   -1.0399 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8782   -2.0700   -0.8414 N   0  0  0  0  0  2  0  0  0  0  0  0
   12.3994   -0.2238   -3.0692 F   0  0  0  0  0  0  0  0  0  0  0  0
   24.0250    1.0517    0.3769 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4037   -0.0695   -3.5647 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3057    1.2435   -1.0811 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7018   -1.0246    1.6844 N   0  0  0  0  0  0  0  0  0  0  0  0
   22.4586    0.8114   -2.4054 O   0  0  0  0  0  1  0  0  0  0  0  0
   24.2800    2.9019   -0.9029 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1759   -2.8451    1.5286 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6580    2.8314    0.1048 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.4709   -4.2346   -0.4375 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5646   -0.9172    2.1223 S   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4288   -0.7400   -2.0589 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.9097   -0.7958   -2.2352 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3352   -1.7661   -2.8662 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1290    0.1336   -1.6749 C   0  0  0  0  0  2  0  0  0  0  0  0
  -10.7303    0.1613   -1.6010 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.3347    0.2349   -1.5236 C   0  0  0  0  0  2  0  0  0  0  0  0
  -13.8536    0.3018   -1.6196 N   0  0  0  0  0  2  0  0  0  0  0  0
  -14.5487    0.4115   -0.4560 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.0232    0.3770   -0.6049 C   0  0  0  0  0  2  0  0  0  0  0  0
  -14.1109    0.5682    0.6841 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.7040    0.3969   -0.6864 C   0  0  0  0  0  2  0  0  0  0  0  0
  -19.1942    0.4039   -0.8421 C   0  0  0  0  0  3  0  0  0  0  0  0
  -20.0014    0.3850    0.2923 N   0  0  0  0  0  2  0  0  0  0  0  0
  -21.3793    0.3979    0.1927 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.6745    0.4910   -2.3923 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.7111   -0.6111   -3.0444 O   0  0  0  0  0  1  0  0  0  0  0  0
  -19.6753    1.6586   -2.9232 O   0  0  0  0  0  0  0  0  0  0  0  0
  -21.9465    1.0375    1.2609 N   0  0  0  0  0  2  0  0  0  0  0  0
  -23.2705    1.0486    1.6999 C   0  0  0  0  0  3  0  0  0  0  0  0
  -22.0111   -0.1118   -0.7266 O   0  0  0  0  0  0  0  0  0  0  0  0
  -24.3233    0.0983    1.3386 C   0  0  0  0  0  2  0  0  0  0  0  0
  -23.7358    2.1147    2.8065 C   0  0  0  0  0  0  0  0  0  0  0  0
  -24.2042    3.2285    2.3778 O   0  0  0  0  0  0  0  0  0  0  0  0
  -23.7868    1.7214    4.0169 O   0  0  0  0  0  1  0  0  0  0  0  0
  -25.6875   -0.7231    1.1018 C   0  0  0  0  0  2  0  0  0  0  0  0
  -27.0630   -1.4292    0.9041 C   0  0  0  0  0  0  0  0  0  0  0  0
  -27.2434   -2.5929    1.4273 O   0  0  0  0  0  1  0  0  0  0  0  0
  -27.9779   -0.7903    0.2714 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6053    0.2151   -1.6497 N   0  0  0  0  0  2  0  0  0  0  0  0
  -11.1215   -1.4979    3.8239 C   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  1  0
  2  4  1  0
  3 67  1  0
  4  8  2  0
  4  9  1  0
  5  8  1  0
  5 49  1  0
  6  9  2  0
  6 10  1  0
  7 13  1  0
  7 51  1  0
  8 16  1  0
  9 19  1  0
 10 22  2  0
 11 18  1  0
 11 44  2  0
 11 51  1  0
 12 20  1  0
 12 45  2  0
 12 49  1  0
 13 43  1  0
 14 24  1  0
 14 46  1  0
 14 53  1  0
 15  3  1  0
 15 26  1  0
 15 55  1  0
 16 21  1  0
 16 54  2  0
 17 25  1  0
 17 48  2  0
 17 53  1  0
 18 47  1  0
 18 64  1  0
 19 27  2  0
 19 54  1  0
 20 23  1  0
 20 31  2  0
 21 30  2  0
 21 49  1  0
 22 27  1  0
 22 56  1  0
 23 57  1  0
 24 47  1  0
 24 59  2  0
 25 33  1  0
 25 50  1  0
 26 50  1  0
 26 58  2  0
 28 34  1  0
 28 35  1  0
 29 35  1  0
 29 60  1  0
 30 31  1  0
 31 36  1  0
 32 38  1  0
 32 52  2  0
 32 60  1  0
 34 55  1  0
 34 65  2  0
 36 37  1  0
 36 41  1  0
 36 61  1  6
 37 57  1  0
 37 62  2  0
 38 40  1  0
 39 40  1  0
 39 60  1  0
 39 63  2  0
 40 66  1  0
 41 42  1  0
 43 10  1  0
 66 96  1  0
 67 68  1  0
 68 69  2  0
 68 95  1  0
 70 71  1  0
 71 72  1  0
 72 73  1  0
 73 74  1  0
 74 75  1  0
 74 76  2  0
 75 77  1  0
 78 77  1  0
 78 79  1  0
 78 81  1  0
 79 80  1  0
 80 84  1  0
 80 86  2  0
 81 82  1  0
 81 83  2  0
 84 85  1  0
 85 87  1  0
 85 88  1  0
 87 91  1  0
 88 89  2  0
 88 90  1  0
 91 92  1  0
 92 93  1  0
 92 94  2  0
 95 70  1  0
M  RAD  8   1   2   2   3   3   3   5   3   6   2   7   3  13   3  14   2
M  RAD  8  15   2  18   2  23   3  25   2  27   2  28   3  29   3  30   2
M  RAD  8  33   2  35   3  38   3  40   2  41   3  42   2  46   2  47   2
M  RAD  8  50   2  51   2  53   2  55   2  61   2  64   2  67   3  70   3
M  RAD  8  71   3  72   3  73   2  75   3  77   3  78   2  79   2  82   2
M  RAD  8  84   2  85   2  87   3  90   2  91   3  93   2  95   2  96   2
M  END
$$$$
