cxypay0030
     RDKit          3D

 38 43  0  0  1  0  0  0  0  0999 V2000
    5.3172   -4.6073   -1.2737 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.5738   -1.6863   -1.9105 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.2203   -0.3168   -2.2167 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6942   -6.0671   -0.9636 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.9513   -3.1445   -1.5854 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.4993    2.4298   -2.0448 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.7257    1.3464   -1.5579 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.1130    3.8774   -1.8922 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.9063    4.2619   -1.2505 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4358    1.7571   -0.8789 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4193   -0.5430   -0.2361 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.5601    5.5971   -1.1164 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.0910    3.1770   -0.7607 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5230    0.8705   -0.3474 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2203   -2.2652    0.6554 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3668    5.8874   -0.4824 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1309    3.5347   -0.1208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6444    1.3579    0.2527 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4062    0.1853    0.6984 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4588    4.8766    0.0018 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.5717   -2.2800    1.3370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3222   -3.4068    1.6813 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.5465    0.0138    1.2735 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.2536   -1.1564    1.6573 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5826    0.4471    0.7188 C   0  0  0  0  0  1  0  0  0  0  0  0
   -4.6318   -1.2382    2.3398 C   0  0  2  0  0  0  0  0  0  0  0  0
   -5.3110   -2.7153    2.4414 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5945   -0.3991    1.5813 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.0567   -7.4532   -0.6730 N   0  0  0  0  0  1  0  0  0  0  0  0
    4.9440    0.2757   -3.0106 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1095    0.0593   -1.5798 N   0  0  0  0  0  2  0  0  0  0  0  0
   -0.6545   -3.3224    0.3752 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7084   -0.9889    0.3706 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0039    7.1679   -0.3344 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0011    2.6454    0.3808 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4870   -3.7956    2.1584 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4861   -0.7760    3.5769 O   0  0  0  0  0  1  0  0  0  0  0  0
   -6.4918   -2.9257    2.7352 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0
  1  5  1  0
  2  3  1  0
  2  5  1  0
  3 30  2  0
  3 31  1  0
  4 29  1  0
  6  7  1  0
  6  8  1  0
  7 10  1  0
  7 31  1  0
  8  9  1  0
  9 12  2  0
  9 13  1  0
 10 13  2  0
 10 14  1  0
 11 14  1  0
 11 33  1  0
 12 16  1  0
 13 17  1  0
 14 18  2  0
 15 21  1  0
 15 32  2  0
 15 33  1  0
 16 20  2  0
 16 34  1  0
 17 20  1  0
 17 35  2  0
 18 19  1  0
 18 35  1  0
 19 23  2  0
 19 33  1  0
 21 22  1  0
 21 24  2  0
 22 36  1  0
 23 24  1  0
 24 26  1  0
 25 28  1  0
 26 27  1  0
 26 28  1  0
 26 37  1  1
 27 36  1  0
 27 38  2  0
M  RAD  8   1   3   2   3   4   3   5   3   6   3   7   2   8   3  11   3
M  RAD  8  12   2  20   2  22   3  23   2  25   2  28   3  29   3  31   2
M  RAD  1  37   2
M  END
$$$$
