SC0248
     RDKit          3D

119127  0  0  1  0  0  0  0  0999 V2000
    1.0839    3.0838   -0.5793 C   0  0  0  0  0  1  0  0  0  0  0  0
    3.1629   -7.7148    2.0925 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.8591    0.3289    4.5749 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.3825   -5.4382    2.8582 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1334   -6.6814    1.9559 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1851   -8.8291    0.0965 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8337   -3.6390    5.4978 C   0  0  0  0  0  1  0  0  0  0  0  0
   -5.5357   -5.6491    5.2406 C   0  0  0  0  0  1  0  0  0  0  0  0
    2.0135   -3.1273   -1.7987 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.7598   -1.3659   -3.3714 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.8526   -0.2993   -3.2863 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3317    1.8345   -2.4181 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.9331    0.3887    2.8770 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8913    1.5641    5.1025 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7499   -4.4483    4.4606 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.9729   -3.8585   -1.2430 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.7438   -2.2769   -2.8736 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9663    2.3967   -2.1402 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9034    1.6706    2.1856 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.2303    2.6419    0.3262 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.6234   -2.9270    2.5680 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.7115   -6.7617    0.7289 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5880   -8.0818   -0.1005 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.4543    2.5176    4.2750 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.9615   -4.2554    0.8446 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5753   -9.0764    0.4459 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.1166   -5.4470    0.3397 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.9874    3.7109    3.3395 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.4606    4.6098    2.4342 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3003   -2.3509    3.2984 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9225   -4.1589    3.0634 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.6223   -4.5042   -1.2845 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3696   -3.7671   -1.6856 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4432   -2.3034   -3.4443 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.1548   -0.1563    3.0984 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.2783    5.0426    2.9341 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.4719   -2.1436    1.6922 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9481    5.7969    3.1854 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.2204   -5.1303    2.0686 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5990   -3.0119   -2.8654 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.2290    0.7312    3.3828 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.6592   -2.9810    0.5761 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8257    6.5254    3.2523 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3547    6.6673    2.0272 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.9318   -1.0864    3.9301 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.6604   -4.4728   -0.1349 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.2359   -0.9989    1.8673 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0070   -3.9699   -0.4003 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.1635    1.0505    2.2439 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.1625   -0.6838    0.8411 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2508   -1.5293   -0.3118 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3594   -3.2015   -0.4030 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.1121    0.3981    0.9598 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6982   -2.4116   -0.5058 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.9952   -1.8148   -0.9785 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0318    0.7057   -0.0414 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1847   -1.2241   -1.2888 C   0  0  0  0  0  3  0  0  0  0  0  0
   10.1992    1.7141    0.1670 C   0  0  0  0  0  1  0  0  0  0  0  0
    8.9943   -0.0509   -1.2121 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0276   -5.6749    3.8900 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5041   -1.3269   -3.0484 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9847   -0.3852    2.6888 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6722   -8.7442    1.3851 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4913    2.5369   -0.8451 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8102    2.8379    1.5434 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7383   -9.6661   -0.7102 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4098   -4.2153    2.1363 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5097   -2.6631    3.3460 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3648    0.9301   -3.0899 N   0  0  0  0  0  2  0  0  0  0  0  0
    4.9988    0.2159    3.7036 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.0282   -4.7834   -2.4089 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5419   -0.3338   -3.7655 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2861   -4.6451    1.2026 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.3705    2.6612   -3.1587 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0259   -7.8639   -1.3364 O   0  0  0  0  0  1  0  0  0  0  0  0
   -5.3125   -2.9131    2.6047 N   0  0  0  0  0  2  0  0  0  0  0  0
   -1.3341   -4.2895   -0.8559 N   0  0  0  0  0  2  0  0  0  0  0  0
   -8.0092    2.7467   -3.3184 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.0203    2.8975   -2.4489 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6714    2.3348   -1.2770 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.1402    1.6195    0.0018 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.3276   -6.3479    2.2927 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5744   -2.7004   -0.3673 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9813   -1.8802   -0.1974 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7462   -1.3772   -0.6684 N   0  0  0  0  0  2  0  0  0  0  0  0
  -10.3110   -1.9740   -2.4473 N   0  0  0  0  0  1  0  0  0  0  0  0
    9.9334    0.0933   -2.1753 F   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7107    0.9303    1.0342 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3919    0.7467    1.0099 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.0254    7.1853   -6.1668 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4952    2.2484   -2.9212 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1768    2.3398   -3.1758 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9660    4.1871   -4.5201 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4088    7.0734   -0.7452 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1746    2.6720   -3.9959 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0586    2.9081    3.1312 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.5782    0.5041    0.6782 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3896    7.5343   -3.9814 N   0  0  0  0  0  2  0  0  0  0  0  0
   -0.8263    0.9521    4.4108 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6893    7.4047   -2.6982 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.8618    0.5690    1.0118 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.8352    1.4085    1.2715 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.8771    6.8106   -4.9946 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0430    2.9829   -4.4116 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7863    3.2580   -5.0704 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.6522    2.6902   -3.9911 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.9120    2.2791    2.1334 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.0490    6.9167    0.5025 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.6411    7.2507   -1.5732 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.3681    5.4642   -4.7505 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.7867    2.1626    4.1879 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3231    3.2565   -4.9042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6637    3.0098   -6.4784 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.7128    3.8740   -6.1367 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.0321    3.2208   -7.9569 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.5161    4.1297   -7.6356 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.3360    3.7838   -8.5296 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.6953  -10.0126    1.0485 C   0  0  0  0  0  1  0  0  0  0  0  0
   -0.2694    2.8922    5.4989 C   0  0  0  0  0  1  0  0  0  0  0  0
  1 64  1  0
  2  5  1  0
  2 63  1  0
  3 45  1  0
  4  5  1  0
  4 60  2  0
  4 67  1  0
  5 22  2  0
  6 23  1  0
  6 63  1  0
  6 66  2  0
  7 15  1  0
  8 15  1  0
  9 16  2  0
  9 17  1  0
 10 17  1  0
 10 72  1  0
 11 61  2  0
 11 69  1  0
 11 72  1  0
 12 18  1  0
 12 69  1  0
 13 19  1  0
 13 62  2  0
 13 70  1  0
 14  3  1  0
 16 33  1  0
 17 34  2  0
 18 64  1  0
 18 74  2  0
 19 65  1  0
 20 64  1  0
 20 65  1  0
 21 37  1  0
 21 67  1  0
 22 23  1  0
 22 27  1  0
 23 26  1  0
 23 75  1  6
 24 14  1  0
 25 27  2  0
 25 42  1  0
 25 67  1  0
 26118  1  0
 28 24  1  0
 29 28  1  0
 30 45  1  0
 30 68  2  0
 30 76  1  0
 31 15  1  0
 31 39  1  0
 31 76  1  0
 32 46  1  0
 32 71  2  0
 32 77  1  0
 33 40  2  0
 33 77  1  0
 34 40  1  0
 35 41  1  0
 35 47  1  0
 35 70  1  0
 36 29  1  0
 37 42  2  0
 37 47  1  0
 38 36  1  0
 39 73  1  0
 39 82  2  0
 41 49  1  0
 42 83  1  0
 43 38  1  0
 44 43  1  0
 46 48  1  0
 46 73  1  0
 47 50  2  0
 48 52  1  0
 49 53  1  0
 50 51  1  0
 50 53  1  0
 51 57  1  0
 51 83  2  0
 52 54  1  0
 53 56  2  0
 54 85  1  0
 55 84  2  0
 55 85  1  0
 55 86  1  0
 56 58  1  0
 56 59  1  0
 57 59  2  0
 59 87  1  0
 78106  1  0
 79 78  1  0
 80 79  1  0
 81 80  1  0
 88 81  1  0
 89 88  1  0
 92 91  2  0
 95 91  1  0
100 98  1  0
101 89  1  0
101 97  1  0
102 97  1  0
103 90  2  0
103 98  1  0
104 92  1  0
105 93  1  0
105104  1  0
106 95  1  0
107 96  1  0
107102  1  0
108 44  1  0
108 94  1  0
109 94  1  0
109100  1  0
110 93  1  0
110103  1  0
111 96  1  0
111 99  2  0
112 95  1  0
112104  2  0
113105  1  0
114112  1  0
115113  1  0
116114  1  0
117115  1  0
117116  1  0
119111  1  0
M  RAD  8   1   2   2   3   3   3   7   2   8   2   9   2  10   3  12   3
M  RAD  8  15   2  16   2  19   3  20   3  21   3  24   3  26   3  27   2
M  RAD  8  28   3  31   2  34   2  35   2  36   3  38   3  40   2  41   3
M  RAD  8  44   3  45   3  46   2  48   3  49   3  52   3  54   3  57   2
M  RAD  8  58   2  69   2  70   2  73   2  75   2  76   2  77   2  78   3
M  RAD  8  80   3  81   3  85   2  86   3  89   3  96   2  98   2 100   3
M  RAD  8 101   3 102   3 105   2 106   3 107   3 108   3 109   3 110   3
M  RAD  7 113   3 114   3 115   3 116   3 117   3 118   2 119   2
M  END
$$$$
