cxy0489
     RDKit          3D

 89 99  0  0  1  0  0  0  0  0999 V2000
  -17.3205    0.3980   -3.1019 C   0  0  0  0  0  1  0  0  0  0  0  0
  -16.5530   -3.3716   -2.6697 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.8016   -0.8940   -2.3739 C   0  0  0  0  0  2  0  0  0  0  0  0
  -14.4505   -3.8989   -2.1201 C   0  0  0  0  0  2  0  0  0  0  0  0
  -16.2921   -2.1133   -1.6716 C   0  0  2  0  0  0  0  0  0  0  0  0
  -13.8784   -2.8270   -1.4314 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.8301   -1.8813   -1.2252 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.4239   -2.6613   -1.0506 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.2849   -0.7125   -0.6354 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.9997   -2.5725    1.6800 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.8223   -3.9551    1.5408 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.0818   -0.4161   -0.2910 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1457   -1.7057    1.0152 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.2325   -4.4619    0.7718 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.9353   -0.7951   -0.1096 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.4667    0.7861    0.2708 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8878   -2.2111    0.2104 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0740   -3.5875    0.0799 C   0  0  0  0  0  3  0  0  0  0  0  0
  -11.0867    0.5404    0.3734 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2012   -1.2962   -2.6835 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.6047   -1.2579   -0.5874 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.3468   -0.1149   -1.9665 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.2625    1.5153    0.8957 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.3472    2.8553    1.1607 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7548   -2.4818   -2.2161 C   0  0  0  0  0  3  0  0  0  0  0  0
   13.1306    1.0900   -0.0049 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.4657    1.7411   -2.7593 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0014   -0.1361   -1.3990 C   0  0  0  0  0  3  0  0  0  0  0  0
   13.1151   -0.0937   -0.7933 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6195    2.2029    1.5208 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8780   -0.5448    2.1597 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.2425   -2.4306   -0.6078 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.1210   -1.0526   -1.8861 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.0697    1.4678   -2.5655 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.0549   -0.0552   -2.5358 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0570    1.0746   -0.4449 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9323    2.7503    1.3433 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7572    1.4132    1.0096 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.0080    4.0036    1.5496 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.2729   -1.8797    2.5835 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8053    0.7579   -2.8370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4664    0.4184   -1.4144 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9371    0.9430    1.7687 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.2201   -2.6787    0.5785 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.7796    0.3835   -2.3402 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.3934    0.6012   -2.3728 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.7251    0.4256   -0.4425 C   0  0  0  0  0  2  0  0  0  0  0  0
   13.5207   -2.4280   -1.0504 C   0  0  0  0  0  3  0  0  0  0  0  0
   13.7067   -1.2522   -0.3049 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1423    2.4825    1.7205 C   0  0  0  0  0  2  0  0  0  0  0  0
  -10.2843    3.8741    1.9796 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.3423    5.0657    2.1555 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9212    1.9876    2.0136 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8913    3.6988    2.1827 C   0  0  0  0  0  2  0  0  0  0  0  0
  -10.9689    5.0190    2.3888 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0133    3.1600    2.7816 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.5759   -1.3199    0.8810 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.3088    0.7645    2.6126 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9149   -0.4317    1.9587 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.2996    3.1214    4.1464 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.2993    6.2267    3.1262 C   0  0  0  0  0  1  0  0  0  0  0  0
   14.3486    0.7410    4.0233 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.2956    1.8967    4.8000 C   0  0  0  0  0  3  0  0  0  0  0  0
  -17.5566   -3.5079   -3.3782 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.5517   -4.3221   -2.7176 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0310   -2.3268   -0.5842 O   0  0  0  0  0  1  0  0  0  0  0  0
  -11.6482   -3.5934   -1.2349 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0938   -1.3961   -0.5104 N   0  0  0  0  0  0  0  0  0  0  0  0
  -13.1162    1.9046    0.6276 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.2134    3.2569    2.0114 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3424    2.3578   -3.3679 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0100   -0.9933   -3.3453 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2220    2.0615   -1.1647 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0412   -2.9192    1.7742 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.7345    1.3099   -2.2079 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.3205   -0.1587   -0.5161 N   0  0  0  0  0  2  0  0  0  0  0  0
   12.9340    2.0269    0.9595 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.3619   -2.3358   -1.6056 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3221    2.2600   -2.3035 N   0  0  0  0  0  2  0  0  0  0  0  0
   -0.9973    0.5977   -1.9879 N   0  0  0  0  0  2  0  0  0  0  0  0
   -8.0196    0.5133    0.3301 N   0  0  0  0  0  2  0  0  0  0  0  0
  -13.0739    6.1311    2.5442 F   0  0  0  0  0  0  0  0  0  0  0  0
   11.9226   -1.9337    3.6281 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8814   -0.1968   -3.6008 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7620    1.2749   -2.2603 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0323   -1.0342    2.5060 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.4958   -2.3655    0.9329 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.3720   -2.1601    1.8072 N   0  0  0  0  0  0  0  0  0  0  0  0
   17.1379   -0.3386    3.2028 C   0  0  0  0  0  1  0  0  0  0  0  0
  1  3  1  0
  2  5  1  0
  2 64  2  0
  2 65  1  0
  4  6  1  0
  4 65  1  0
  5  3  1  0
  5  7  1  0
  5 66  1  1
  6  7  2  0
  6  8  1  0
  7  9  1  0
  8 67  2  0
  8 68  1  0
  9 12  2  0
 10 11  2  0
 10 13  1  0
 11 14  1  0
 12 16  1  0
 12 68  1  0
 13 17  2  0
 14 18  2  0
 15 19  1  0
 15 68  1  0
 16 19  2  0
 16 69  1  0
 17 18  1  0
 17 21  1  0
 19 23  1  0
 20 22  2  0
 20 25  1  0
 22 29  1  0
 23 37  2  0
 23 38  1  0
 24 37  1  0
 24 39  1  0
 24 69  2  0
 25 48  2  0
 26 29  1  0
 26 77  1  0
 27 45  1  0
 27 71  2  0
 27 79  1  0
 28 21  1  0
 28 42  1  0
 28 80  1  0
 29 49  2  0
 30 43  1  0
 30 70  2  0
 30 77  1  0
 31 40  1  0
 31 43  1  0
 32 44  1  0
 32 78  1  0
 33 45  1  0
 33 78  1  0
 34 41  1  0
 34 79  1  0
 35 46  1  0
 35 72  2  0
 35 80  1  0
 36 47  1  0
 36 73  2  0
 36 81  1  0
 37 51  1  0
 38 50  1  0
 38 81  1  0
 39 52  2  0
 40 74  1  0
 40 83  2  0
 41 75  1  0
 41 84  2  0
 42 76  1  0
 42 85  2  0
 44 74  1  0
 46 75  1  0
 47 76  1  0
 48 49  1  0
 49 57  1  0
 50 54  1  0
 51 54  1  0
 51 55  2  0
 52 55  1  0
 52 82  1  0
 53 56  2  0
 53 58  1  0
 53 77  1  0
 55 61  1  0
 56 60  1  0
 57 59  1  0
 57 87  1  0
 58 59  1  0
 58 62  2  0
 59 86  1  0
 60 63  2  0
 62 63  1  0
 86 88  1  0
 86 89  1  0
 88 87  2  0
M  RAD  8   1   2   3   3   4   3   9   2  10   2  11   2  13   2  14   2
M  RAD  8  15   3  18   2  20   2  21   3  22   2  25   2  26   3  28   2
M  RAD  8  31   3  32   3  33   3  34   3  38   2  39   2  43   3  44   3
M  RAD  8  45   3  46   3  47   3  48   2  50   3  54   3  56   2  57   2
M  RAD  8  59   2  60   2  61   2  62   2  63   2  66   2  74   2  75   2
M  RAD  5  76   2  79   2  80   2  81   2  89   2
M  END
$$$$
