CHH0036
     RDKit          3D

127133  0  0  1  0  0  0  0  0999 V2000
   -3.6479    1.6769    2.9235 C   0  0  0  0  0  1  0  0  0  0  0  0
    2.3343  -10.4263   -1.3095 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.9829  -10.8276   -1.7843 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.6973   -9.0044   -1.2972 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.7825    2.4224    0.9578 C   0  0  0  0  0  1  0  0  0  0  0  0
   -0.0929   -9.7964   -1.6883 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.6908    4.7701    6.7008 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.9295   -1.9141    2.9314 C   0  0  0  0  0  1  0  0  0  0  0  0
    6.3410    0.5551    2.3101 C   0  0  0  0  0  1  0  0  0  0  0  0
    7.7665    4.1822    0.8211 C   0  0  0  0  0  1  0  0  0  0  0  0
    0.3409   -8.3303   -1.5164 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.7977   -0.8613    1.8191 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.2474    4.6223    1.1288 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.6664    1.2276    8.8073 C   0  0  0  0  0  1  0  0  0  0  0  0
    5.3017    4.4142    5.2837 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.3235    4.1714    6.8686 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.5737    1.1698   -0.6358 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.8614   -1.9505    1.9047 C   0  0  0  0  0  1  0  0  0  0  0  0
   -8.6238    0.4573    1.0161 C   0  0  0  0  0  1  0  0  0  0  0  0
    2.6804   -1.4732   -0.4269 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0135   -1.0217    0.6427 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.2410    3.8289    0.3466 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.6836    3.2836    5.9321 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.7096    1.4511    7.5039 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.1580   -0.5793    7.7273 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.7204   -5.3578   -1.8185 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.2072   -3.3859   -1.5217 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.4703    2.9325   -1.8823 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6845    3.6224    2.3257 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.2809   -0.2599    7.0126 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.2305    1.3985   -0.7169 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1095   -1.1259    0.7221 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.5280   -5.9162   -1.4779 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9727   -3.9842   -1.9573 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5832   -0.3666   -0.6809 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0420    1.7172   -1.4439 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.8941    3.4078    0.9276 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.4601    4.0906    3.6885 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4528    1.8832    6.3275 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.3366    1.9761    7.6838 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1525    0.4387    8.8339 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.0977   -1.0256    6.9556 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4097   -0.6226    6.2662 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.3808    1.2094   -1.4061 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1835    1.3185   -1.6769 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2286    1.5398   -1.6118 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.8571   -1.7068   -0.5655 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.5180    1.5366   -1.8838 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.6208    0.1665   10.1781 C   0  0  0  0  0  1  0  0  0  0  0  0
   -4.9289    1.2250   -5.1860 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.4765    1.8806   -8.3575 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3184    3.7625   -6.8277 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.6960    3.7995   -3.0580 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.1453    2.3629   -2.2345 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.8899   -0.0882   -2.0549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7297   -4.2708   -0.3817 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6854   -4.9743   -1.3464 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0637   -3.1474   -1.9231 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.0126   -0.0903    1.8785 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.0868   -2.1767    6.1355 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.3872   -1.8006    5.4781 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.7511    1.0360   -2.9290 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5922    1.9047   -6.3423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9370    4.4498   -5.5065 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.2870   -3.1576   -0.5536 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4670    0.4307   -1.2451 C   0  0  0  0  0  1  0  0  0  0  0  0
   -4.0685    0.9301   -3.9011 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.9345    1.4305   -7.9189 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.5785    4.3423   -4.0384 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.9566    1.0570   -2.1567 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.3092   -4.4069   -0.4959 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.3812   -3.5983   -1.7270 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.2808    2.7861   -2.3400 C   0  0  0  0  0  1  0  0  0  0  0  0
    2.0128    4.4780    0.0952 C   0  0  0  0  0  1  0  0  0  0  0  0
    5.7138    1.1258    5.9410 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.2782   -2.6134    5.4873 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.9666    1.3052   -2.7240 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.3756    0.0519   -8.3011 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.9503   -5.6679    0.2434 C   0  0  0  0  0  1  0  0  0  0  0  0
    0.2975    0.9936   -3.9487 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.9803  -11.1226   -0.4283 O   0  0  0  0  0  1  0  0  0  0  0  0
    4.6075   -8.4128   -2.7849 O   0  0  0  0  0  1  0  0  0  0  0  0
    0.9161  -11.8668   -2.5634 O   0  0  0  0  0  1  0  0  0  0  0  0
   -3.6248    1.7480    1.4220 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6861   -8.0108   -1.7149 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8507    1.3074    0.7820 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2810   -9.9926   -2.0964 O   0  0  0  0  0  1  0  0  0  0  0  0
    1.5515   -0.9861   -0.5647 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1478    3.0892   -3.1007 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2716   -1.1995    7.6419 O   0  0  0  0  0  1  0  0  0  0  0  0
    5.3170    0.9504   -0.6777 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.7945    1.6056    8.8109 N   0  0  0  0  0  2  0  0  0  0  0  0
    4.3486    3.6130    4.7155 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6922   -7.3262   -1.3374 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2409   -3.3857    0.3958 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8187    1.0715   -9.0436 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0613    0.1404   -2.3977 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2260    4.0823   -1.0279 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5272   -0.9091    0.6645 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1629   -2.6286   -0.9358 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8462    2.2579   -7.4379 N   0  0  0  0  0  2  0  0  0  0  0  0
   -5.9627   -3.1870   -0.4925 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.8554    5.1498   -4.8125 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1371    0.9108   -2.7507 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.1129   -1.1367   -1.4347 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8478    3.2909    0.0517 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8341    5.1521    3.8697 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2674    0.9059    5.7247 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8415    2.7555    6.8931 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3752   -1.3143   -1.8073 N   0  0  0  0  0  2  0  0  0  0  0  0
   -2.9863   -5.2509   -0.9702 N   0  0  0  0  0  2  0  0  0  0  0  0
   -2.0421    3.1481   -8.1532 N   0  0  0  0  0  2  0  0  0  0  0  0
   -6.5935    3.5854   -2.0812 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0413    0.9880   -4.0580 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7386    2.3393   -6.1337 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1048   -4.0473   -0.6464 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3709   -1.4650   -8.7242 S   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7753   -1.0390  -10.1138 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3519   -2.5041   -8.6754 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3803   -1.3335   -7.6505 O   0  0  0  0  0  1  0  0  0  0  0  0
    4.1618   -8.4787   -1.5276 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8594   -8.1072   -0.5117 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0087    5.8911    1.6321 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.8191    7.3129    2.1858 C   0  0  0  0  0  1  0  0  0  0  0  0
    5.0813    5.5538   -1.4583 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.2344    1.6534    0.7030 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.9735    2.2226    1.4338 C   0  0  0  0  0  1  0  0  0  0  0  0
  1 84  1  0
  2  3  1  0
  2  4  1  0
  2 81  1  0
  3  6  1  0
  3 83  1  0
  4 85  1  0
  4121  1  0
  5 86  1  0
  6 11  1  0
  6 87  1  0
  7 15  1  0
  7 16  1  0
  8 12  1  0
  9 12  1  0
 11 94  1  0
 11 85  1  0
 13 10  1  0
 13 22  1  0
 13123  1  0
 15 93  1  0
 17 44  1  0
 17 86  1  0
 18 32  1  0
 19 32  1  0
 20 88  2  0
 20 99  1  0
 20100  1  0
 21 12  1  0
 21 35  1  0
 21 99  1  0
 22 37  1  0
 22 98  1  0
 23 16  1  0
 23 39  1  0
 23 93  1  0
 24 14  1  0
 24 39  1  0
 24 40  1  0
 25 41  1  0
 25 42  1  0
 25 90  1  0
 26 33  2  0
 26 34  1  0
 27 34  1  0
 27100  1  0
 28 89  2  0
 28 98  1  0
 29 38  1  0
 30 42  2  0
 30 43  1  0
 31 44  2  0
 31 45  1  0
 31126  1  0
 33 57  1  0
 33 94  1  0
 34 58  2  0
 35105  2  0
 35 91  1  0
 36 28  1  0
 36 48  1  0
 37 29  1  0
 37106  1  0
 38 93  1  0
 38107  2  0
 39108  1  0
 40 92  1  0
 40109  2  0
 41 49  1  0
 41 92  1  0
 42 60  1  0
 43 61  2  0
 44104  1  0
 45 46  2  0
 45 62  1  0
 46 77  1  0
 47 32  1  0
 47 65  1  0
 47110  1  0
 48 66  1  0
 48 73  1  0
 50 63  1  0
 50 67  1  0
 51 68  1  0
 51 96  2  0
 51112  1  0
 52 64  1  0
 52112  1  0
 53 69  1  0
 53113  1  0
 54 70  1  0
 54113  1  0
 55 70  1  0
 55 97  2  0
 55110  1  0
 56 71  1  0
 56 95  2  0
 56111  1  0
 57 72  2  0
 57111  1  0
 58 72  1  0
 59 99  1  0
 60 76  2  0
 61 76  1  0
 62104  1  0
 62114  2  0
 63101  1  0
 63115  2  0
 64103  1  0
 65102  1  0
 65116  2  0
 67104  1  0
 68 78  1  0
 69103  1  0
 71 79  1  0
 71102  1  0
 74106  1  0
 75108  1  0
 77 80  2  0
 78117  1  0
 80114  1  0
 84126  1  0
 86 84  1  0
 91 36  1  0
 98125  1  0
101 68  1  0
117118  2  0
117119  2  0
117120  1  0
121122  2  0
121 82  1  0
123124  1  0
126127  1  0
M  RAD  8   1   2   2   2   3   2   4   2   5   2   6   2   7   3   8   2
M  RAD  8   9   2  10   2  11   2  12   2  13   2  14   2  15   3  16   3
M  RAD  8  17   3  18   2  19   2  21   2  22   2  23   2  24   2  25   2
M  RAD  8  26   2  27   3  29   3  30   2  32   2  36   2  37   2  39   2
M  RAD  8  41   2  43   2  46   2  47   2  48   2  49   2  50   3  52   3
M  RAD  8  53   3  54   3  58   2  59   2  60   2  61   2  64   3  66   2
M  RAD  8  67   3  68   2  69   3  70   3  71   2  72   2  73   2  74   2
M  RAD  8  75   2  76   2  77   2  78   3  79   2  80   2  81   2  82   2
M  RAD  8  83   2  87   2  90   2  91   2  92   2 101   2 102   2 110   2
M  RAD  8 111   2 112   2 120   2 123   3 124   2 125   2 126   2 127   2
M  END
$$$$
