cxy0304
     RDKit          3D

 77 83  0  0  1  0  0  0  0  0999 V2000
  -17.3616    1.5121    1.5426 C   0  0  0  0  0  2  0  0  0  0  0  0
  -15.9734    2.1500    1.1818 C   0  0  0  0  0  2  0  0  0  0  0  0
  -15.9219    3.5551    0.8584 C   0  0  0  0  0  3  0  0  0  0  0  0
  -18.4329    3.2143    1.3664 C   0  0  0  0  0  2  0  0  0  0  0  0
  -17.2300    4.1579    0.9983 C   0  0  0  0  0  2  0  0  0  0  0  0
  -13.6995    3.3886    0.0866 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.5320    2.4016   -0.1548 C   0  0  0  0  0  2  0  0  0  0  0  0
  -13.2622    0.3242   -1.9949 C   0  0  0  0  0  3  0  0  0  0  0  0
  -11.6206    1.3336   -0.4640 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5903    2.0714    0.9708 C   0  0  0  0  0  2  0  0  0  0  0  0
  -13.5809   -0.7167   -2.8305 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0060    0.2994   -1.3586 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3595    1.2629    0.0832 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2724    2.0295    2.0371 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3178   -2.0316   -4.0398 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.6682   -1.7737   -3.0688 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5473    0.1660   -0.2174 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0807   -0.7814   -1.6080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2971    0.3601    0.5310 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.4321   -1.8179   -2.4663 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.0278    1.1519    1.9936 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7854    1.3934    2.6197 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.1955   -0.3018    0.6267 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.9825   -0.0228    1.3162 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2665    1.0838    1.6446 C   0  0  0  0  0  1  0  0  0  0  0  0
   -4.6146   -0.8417    1.2172 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.8840   -0.6262    2.6113 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.7079    1.4418   -2.5447 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.3661    1.1995   -2.2280 C   0  0  0  0  0  2  0  0  0  0  0  0
   17.5347    1.1361   -1.8155 C   0  0  0  0  0  2  0  0  0  0  0  0
   15.4123    0.8604   -1.3364 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.8273   -0.6921   -1.2786 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7918   -0.7141    0.0633 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.0717   -1.3111    1.0310 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8297   -0.4007    1.3417 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.3461   -2.8419    0.0493 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0399   -2.5858    1.3967 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7978   -1.5918    1.3419 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.9864    1.6609   -1.8622 C   0  0  0  0  0  2  0  0  0  0  0  0
   20.9868    0.6379   -2.6980 C   0  0  0  0  0  2  0  0  0  0  0  0
   18.8017    0.5961   -2.5044 C   0  0  0  0  0  2  0  0  0  0  0  0
   14.0927    0.0498   -1.3842 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.8427   -1.3289    1.0238 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5573   -0.8074    1.1331 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.3006   -1.9951    1.0884 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.7904    0.5301    1.6251 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.0696    0.9057    3.1466 C   0  0  0  0  0  1  0  0  0  0  0  0
    7.9779    1.8032    0.6593 C   0  0  0  0  0  1  0  0  0  0  0  0
  -18.6500    1.9133    1.6407 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.9051    4.2102    0.2804 N   0  0  0  0  0  2  0  0  0  0  0  0
  -14.7629   -0.8993   -3.5192 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3237    3.0540    2.7169 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3490    1.5772    1.2401 N   0  0  0  0  0  0  0  0  0  0  0  0
  -13.1905   -2.7201   -3.9402 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8743   -0.8517   -1.0216 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6611    0.7372    2.8905 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2161   -3.3614    0.5421 N   0  0  0  0  0  2  0  0  0  0  0  0
   24.7435    1.0494   -3.7093 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8217   -1.8262   -1.7402 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8442   -2.4783    0.7086 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1764   -3.0844    2.5126 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5844   -1.5889    0.6109 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.6173   -1.2562    0.7555 N   0  0  0  0  0  2  0  0  0  0  0  0
   -5.0443   -2.1847    1.0114 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.8510    0.0762   -3.1484 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8806   -1.4099    3.5677 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.6659    1.7203   -1.7590 N   0  0  0  0  0  2  0  0  0  0  0  0
   16.4774    1.6476   -1.1954 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8600    0.0306   -0.6946 N   0  0  0  0  0  2  0  0  0  0  0  0
    5.2016   -0.3349    1.2826 N   0  0  0  0  0  2  0  0  0  0  0  0
   -2.0080   -2.3935    0.4525 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.8644   -3.0107   -1.0658 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.3303   -1.6408    2.1067 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0745   -2.6742    1.8833 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.3663    1.8449   -1.1307 C   0  0  0  0  0  1  0  0  0  0  0  0
   -3.9289   -0.1492    0.0745 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.5527    0.8344   -1.0831 C   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  1  0
  1 49  1  0
  2  3  1  0
  3  5  1  0
  3 50  1  0
  4  5  1  0
  4 49  1  0
  6  7  1  0
  6 50  1  0
  7  9  1  0
  8 11  2  0
  8 12  1  0
  9 12  2  0
  9 13  1  0
 10 13  1  0
 10 53  1  0
 11 16  1  0
 11 51  1  0
 12 18  1  0
 13 17  2  0
 14 21  1  0
 14 52  2  0
 14 53  1  0
 15 51  1  0
 15 54  1  0
 16 20  2  0
 16 54  1  0
 17 19  1  0
 17 55  1  0
 18 20  1  0
 18 55  2  0
 19 23  2  0
 19 53  1  0
 21 22  1  0
 21 24  2  0
 22 56  1  0
 23 24  1  0
 24 26  1  0
 26 27  1  0
 26 64  1  0
 26 76  1  6
 27 56  1  0
 27 66  2  0
 28 39  1  0
 28 58  2  0
 28 67  1  0
 29 40  1  0
 29 67  1  0
 30 41  1  0
 30 68  1  0
 31 42  1  0
 31 68  1  0
 32 42  1  0
 32 59  2  0
 32 69  1  0
 33 43  1  0
 33 69  1  0
 34 44  1  0
 34 60  2  0
 34 70  1  0
 35 25  1  0
 35 38  1  0
 35 70  1  0
 36 57  1  0
 36 64  1  0
 36 72  2  0
 37 45  1  0
 37 61  2  0
 37 71  1  0
 38 63  1  0
 38 74  2  0
 40 65  1  0
 41 65  1  0
 43 62  1  0
 43 73  2  0
 44 46  1  0
 44 62  1  0
 45 63  1  0
 46 47  1  0
 46 48  1  0
 57 71  1  0
 75 39  1  0
 76 77  1  0
M  RAD  8   1   3   2   3   3   2   4   3   5   3   6   3   7   3   8   2
M  RAD  8  10   3  15   3  20   2  22   3  23   2  25   2  29   3  30   3
M  RAD  8  31   3  33   3  35   2  39   3  40   3  41   3  42   3  44   2
M  RAD  8  45   3  46   2  47   2  48   2  50   2  57   2  62   2  63   2
M  RAD  7  67   2  69   2  70   2  71   2  75   2  76   3  77   2
M  END
$$$$
