cxy0278
     RDKit          3D

 72 78  0  0  1  0  0  0  0  0999 V2000
  -14.3070    1.1973    1.8596 C   0  0  0  0  0  1  0  0  0  0  0  0
  -14.3159    3.2833   -1.3264 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.8096    1.5944    0.4262 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.3797    4.4028   -1.5370 C   0  0  0  0  0  2  0  0  0  0  0  0
  -13.3360    2.0279   -0.9202 C   0  0  2  0  0  0  0  0  0  0  0  0
  -11.3328    3.5571   -1.1317 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8216    2.3286   -0.8343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8763    3.9232   -0.9581 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7998    1.4270   -0.4293 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.5388    1.5914   -0.2543 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1660    3.0464    0.7679 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1802    2.0548   -1.0500 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.7265    2.8207   -0.1677 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.1708   -1.9400    1.3997 C   0  0  0  0  0  1  0  0  0  0  0  0
    9.2266   -4.1871    0.0797 C   0  0  0  0  0  1  0  0  0  0  0  0
   -8.4287    0.7078    0.1640 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7175    1.0107   -0.2965 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3588   -2.8763    0.4019 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.2841    1.5305    0.2415 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0508    1.0663    1.0358 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.8464    0.0228   -0.8208 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2433   -2.4591   -0.4324 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.0928    0.9855    0.6322 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2906   -1.1555    0.7629 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0153   -0.7253   -1.2538 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3831   -1.1315   -1.9747 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3501   -2.0154    1.4826 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1827    0.0783    1.6969 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.6121    2.5528    1.1514 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.2497   -1.8107   -1.9701 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.2990   -2.5283    0.9775 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.8878   -2.9481    0.1052 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6339   -2.2809    0.0081 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.0194    0.9677    1.4852 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2921    2.7876    2.2836 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.2864    3.2093    1.5738 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.0643   -0.4047    0.8938 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9156    1.7884    0.8183 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.7212   -1.4438   -1.6944 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.7145   -1.7082   -2.0861 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.8694   -1.0538    1.2683 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.1197   -3.1421    1.3210 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4758   -2.3942   -0.8070 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.1173   -2.6586   -1.4822 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.9152   -2.4038    1.4868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2755   -3.1495   -1.9727 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.6444   -4.2999    1.8316 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.6104   -3.8396   -2.3338 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.9387   -3.8663   -3.0369 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.5102   -5.6832   -3.5570 C   0  0  0  0  0  1  0  0  0  0  0  0
  -15.5499    3.2562   -1.3156 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.6832    4.4845   -1.6748 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5192    1.0585   -1.7982 O   0  0  0  0  0  1  0  0  0  0  0  0
   -9.4733    5.0540   -1.2016 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.7144    4.1010    0.9982 C   0  0  0  0  0  1  0  0  0  0  0  0
   18.0049    4.4455    1.5331 S   0  0  0  0  0  0  0  0  0  0  0  0
   16.9016    3.0854   -0.5555 N   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0508    2.8968   -0.4706 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.7827    2.0552    1.5883 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.3415    0.0907   -2.1837 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9551   -2.9401    2.2018 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4659   -0.5943    0.4283 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8157   -2.5759   -0.6102 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.6757    1.6973    2.5571 N   0  0  0  0  0  2  0  0  0  0  0  0
   -1.1639    3.7698    2.0194 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4432   -0.7246    1.8618 N   0  0  0  0  0  2  0  0  0  0  0  0
    7.3557   -1.9285   -1.6960 N   0  0  0  0  0  2  0  0  0  0  0  0
    5.9353   -3.7219    1.0682 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5594    1.0297    0.3375 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9300   -4.4986    1.5636 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8630   -3.2353    1.8437 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8043   -4.6622   -2.5533 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0
  2  5  1  0
  2 51  2  0
  2 52  1  0
  4  6  1  0
  4 52  1  0
  5  3  1  0
  5  7  1  0
  5 53  1  6
  6  7  2  0
  6  8  1  0
  7  9  1  0
  8 54  2  0
  8 58  1  0
  9 10  2  0
 10 16  1  0
 10 58  1  0
 11 56  1  0
 11 57  2  0
 11 59  1  0
 12 17  2  0
 12 57  1  0
 13 19  1  0
 13 58  1  0
 14 18  1  0
 15 18  1  0
 16 19  2  0
 16 62  1  0
 17 20  1  0
 17 21  1  0
 18 22  1  0
 19 23  1  0
 20 59  2  0
 21 25  3  0
 22 32  1  0
 22 67  1  0
 23 37  2  0
 23 38  1  0
 24 31  1  0
 24 37  1  0
 24 62  2  0
 25 39  1  0
 26 40  1  0
 26 60  2  0
 26 67  1  0
 27 33  1  0
 27 61  2  0
 27 66  1  0
 28 34  1  0
 28 66  1  0
 29 36  1  0
 29 38  1  0
 30 39  1  0
 30 40  1  0
 31 42  2  0
 32 63  1  0
 32 68  2  0
 33 43  1  0
 33 63  1  0
 34 64  1  0
 34 69  2  0
 35 64  1  0
 35 65  1  0
 36 65  1  0
 37 41  1  0
 41 45  2  0
 42 45  1  0
 42 70  1  0
 43 44  1  0
 44 46  1  0
 45 71  1  0
 46 48  1  0
 47 70  1  0
 47 71  1  0
 48 72  1  0
 49 72  1  0
 50 72  1  0
 55 56  1  0
M  RAD  8   1   2   3   3   4   3   9   2  12   2  13   3  14   2  15   2
M  RAD  8  18   2  20   2  22   2  28   3  29   3  30   3  31   2  33   2
M  RAD  8  35   3  36   3  38   3  39   3  40   3  41   2  43   3  44   3
M  RAD  8  46   3  47   3  48   3  49   2  50   2  53   2  55   2  63   2
M  RAD  3  64   2  66   2  67   2
M  END
$$$$
