SC0225
     RDKit          3D

111118  0  0  1  0  0  0  0  0999 V2000
    3.5847   -2.5308    2.6722 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7657   -1.6558    3.7695 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1897   -2.3898    4.8879 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2088   -3.7685    4.5147 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.7574   -3.9538    3.1845 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.6413   -1.9723    5.9507 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4607   -2.2022    1.5041 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8359   -0.2976    3.7267 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.2301    1.1895    3.8168 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.7828    2.5101    3.9977 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2210    3.2935    4.9023 N   0  0  0  0  0  2  0  0  0  0  0  0
    5.7284    2.8330    3.2739 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8160    3.6097    4.5792 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.3702    3.9578    4.1592 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.1372    4.2247    3.7267 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7272    3.6270    4.5448 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.7271    2.8516    5.4292 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.5339    2.1166    6.1993 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8991    1.0643    5.4739 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.2929   -0.1128    4.5437 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.6285   -1.0395    3.6501 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9990   -2.1584    4.2432 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.4477   -3.5393    4.8109 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.8353   -4.7455    5.2122 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5869   -5.2148    4.2195 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.4311   -5.6336    2.9747 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.2253   -5.9488    1.9441 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8343   -5.2362    0.8885 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.4340   -4.3747   -0.3311 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.0990   -3.6373   -1.3794 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7885   -3.4348   -1.3325 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.2461   -3.2235   -1.3064 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.9275   -3.1181   -1.3325 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5449   -2.5185   -0.2147 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.0323   -1.8135    1.0766 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.5067   -1.1938    2.1400 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3654   -2.0882    3.1161 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.0800   -3.1832    4.1381 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.5266   -4.3389    4.7858 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1682   -5.4701    4.2078 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.4895   -4.1167    5.5244 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8227   -6.2568    4.7391 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.7653   -6.9272    3.7330 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1502   -7.3249    2.6031 N   0  0  0  0  0  2  0  0  0  0  0  0
   -1.1212   -6.3995    6.1664 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.1735   -5.8785    7.3275 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.0232   -7.5470    6.8207 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.9587   -7.0426    4.0559 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7603   -7.2436    1.3893 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.9620   -7.6518    0.1022 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3727   -7.4319    0.1595 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.3116   -6.9180    1.1646 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.5353   -8.2186   -0.8443 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7890   -6.3626   -0.5593 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1876   -6.4305   -1.8946 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.7535   -5.3385   -2.5500 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.9784   -4.1421   -1.8676 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6019   -4.0355   -0.5377 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.0161   -5.1463    0.0876 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.6863   -3.0900   -2.5201 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.3985   -2.1475   -3.1473 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7205   -1.3729   -4.0521 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5451   -0.3205   -4.5666 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5122   -1.4826   -4.3153 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7558    0.7955   -3.6383 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9841    2.1460   -3.9812 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9211    2.8311   -5.3056 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3233    2.2571   -6.4098 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5511    1.0090   -6.3943 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.4498   -0.0848   -5.9300 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.9049   -0.9736   -6.6978 O   0  0  0  0  0  1  0  0  0  0  0  0
    2.0454    1.0134   -7.7915 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.0144    2.7996   -7.6189 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.2168    2.2382   -8.4896 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6853    1.1309   -5.7184 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8962    3.0391   -8.8263 C   0  0  0  0  0  1  0  0  0  0  0  0
    4.4192    3.9593   -5.3936 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8034    0.4811   -2.2704 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.1856    3.0910   -2.9541 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.9920    1.4253   -1.2575 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2036    2.7585   -1.5917 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3309    3.6983   -0.5842 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6746    5.0024   -1.0200 C   0  0  0  0  0  1  0  0  0  0  0  0
    3.9311    1.0186    0.0367 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6966    1.2412    0.4985 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.2401    1.5539    0.8700 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.2416    1.8506    1.0604 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.7408    2.1514    1.1004 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.2423    2.4409    0.9086 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.5102    2.7460    0.6050 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5312    3.4391   -0.5839 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0256    4.7428   -0.6351 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.1026    5.5182   -1.8029 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7264    4.9613   -2.9610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2401    3.6629   -2.8970 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.1510    2.8987   -1.7106 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6476    1.6101   -1.6561 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9945    1.5534   -2.0949 C   0  0  0  0  0  1  0  0  0  0  0  0
   -3.5627    6.8171   -1.6637 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1194    7.1766   -2.6961 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.8976    7.1564   -4.1287 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.1921    6.6648   -4.7324 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0468    5.6993   -4.2078 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1350    5.4651   -4.7280 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7748    8.4264   -4.8564 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.7326    8.6407   -5.8827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4339    7.5701   -5.7280 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.1187    6.4492   -4.4310 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3885    9.2874   -7.2181 C   0  0  0  0  0  1  0  0  0  0  0  0
    4.2638   -5.1043    2.0371 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.0663   -4.7691    2.1031 C   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  1  0
  1  7  2  0
  2  3  1  0
  2  8  1  0
  3  4  1  0
  3  6  2  0
  4  5  1  0
  5  1  1  0
  5110  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 11 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  1  0
 36 37  1  0
 37 38  1  0
 38 39  1  0
 39 40  1  0
 39 41  2  0
 42 40  1  0
 42 43  1  0
 42 45  1  0
 43 44  1  0
 43 48  2  0
 44 49  1  0
 45 46  1  0
 45 47  1  0
 49 50  1  0
 49 52  1  0
 50 51  1  0
 50 53  2  0
 51 54  1  0
 54 55  2  0
 55 56  1  0
 56 57  2  0
 57 58  1  0
 57 60  1  0
 58 59  2  0
 59 54  1  0
 60 61  1  0
 61 62  1  0
 62 63  1  0
 62 64  2  0
 63 65  1  0
 65 66  2  0
 65 78  1  0
 66 67  1  0
 66 79  1  0
 67 68  1  0
 67 77  2  0
 68 69  1  0
 68 73  1  0
 69 70  1  0
 69 72  1  0
 69 75  1  1
 70 63  1  0
 70 71  1  0
 72 74  1  0
 73 74  2  0
 74 76  1  0
 78 80  2  0
 80 81  1  0
 80 84  1  0
 81 79  2  0
 81 82  1  0
 82 83  1  0
 84 85  1  0
 85 86  1  0
 86 87  1  0
 87 88  1  0
 88 89  1  0
 89 90  1  0
 90 91  1  0
 91 92  2  0
 92 93  1  0
 93 94  2  0
 93 99  1  0
 94 95  1  0
 95 96  2  0
 96 91  1  0
 96 97  1  0
 97 98  1  0
 99100  2  0
100101  1  0
101102  1  0
101105  1  0
101108  1  1
102103  1  0
103104  2  0
103 94  1  0
105106  1  0
106107  2  0
106109  1  0
107102  1  0
111110  1  0
M  RAD  8   4   3   5   2   8   3   9   3  11   2  13   3  14   3  16   3
M  RAD  8  17   3  19   3  20   3  22   3  23   3  25   3  26   3  28   3
M  RAD  8  29   3  31   3  32   3  34   3  35   3  37   3  38   3  40   2
M  RAD  8  42   2  44   2  45   2  46   2  47   2  49   2  51   2  52   2
M  RAD  8  55   2  56   2  58   2  59   2  60   3  70   2  71   2  72   3
M  RAD  8  73   2  76   2  78   2  79   2  83   2  85   3  86   3  87   3
M  RAD  8  88   3  89   3  92   2  95   2  98   2 100   2 105   3 107   2
M  RAD  2 109   2 111   2
M  END
$$$$
