cxylin0238
     RDKit          3D

 67 69  0  0  1  0  0  0  0  0999 V2000
    7.7287   -1.4453    1.0264 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.9866   -1.5381    0.2794 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.3939   -1.4181    1.7896 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.8291   -3.7967    1.6247 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.5854   -2.5201    2.0805 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.0218   -1.9163   -0.2441 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1973   -1.7989    0.8449 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.4763   -4.4930    0.1453 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.7367   -3.9051   -1.0752 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.4234   -2.0922   -0.2320 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.2429   -0.5474   -1.2297 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.1771   -1.9823   -1.7561 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.1445    0.7751    0.0359 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.1235    0.8746    0.9061 C   0  0  0  0  0  2  0  0  0  0  0  0
  -17.9046    5.8387   -0.4076 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.4062    0.3310   -0.1408 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.2469    0.6947    0.8218 C   0  0  0  0  0  2  0  0  0  0  0  0
   14.4770   -1.5648    0.7555 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4557    0.6858   -0.6918 C   0  0  0  0  0  2  0  0  0  0  0  0
  -20.2052   -0.3488    1.3852 O   0  0  0  0  0  1  0  0  0  0  0  0
  -17.9656    4.3022   -0.3170 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.6827    1.5653   -0.4058 C   0  0  0  0  0  2  0  0  0  0  0  0
  -18.0551    2.7677   -0.2301 C   0  0  0  0  0  2  0  0  0  0  0  0
   15.7393   -0.8924    0.3481 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.8236    1.0488    2.2380 C   0  0  0  0  0  2  0  0  0  0  0  0
   16.4722   -0.0244    1.2468 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.2673    1.7768    0.9892 C   0  0  0  0  0  2  0  0  0  0  0  0
  -10.8016   -0.7552    2.7515 C   0  0  0  0  0  2  0  0  0  0  0  0
  -19.7077   -0.7342    0.2751 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1377   -0.6037   -1.0121 C   0  0  0  0  0  2  0  0  0  0  0  0
  -18.1773    1.2335   -0.1542 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.0956   -3.0543    1.2963 N   0  0  0  0  0  2  0  0  0  0  0  0
   17.3999    1.1434    0.7975 C   0  0  0  0  0  2  0  0  0  0  0  0
  -11.4268   -1.9825    2.0588 C   0  0  0  0  0  2  0  0  0  0  0  0
  -18.2786   -0.1828   -0.0478 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.6193   -3.0486   -0.4940 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.3130   -2.6844    0.0299 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.8067   -2.7590   -0.5351 C   0  0  0  0  0  2  0  0  0  0  0  0
   17.0710    0.5662   -1.4548 C   0  0  0  0  0  2  0  0  0  0  0  0
   17.6933    1.5234   -0.5674 C   0  0  0  0  0  3  0  0  0  0  0  0
  -17.0019   -2.1374    0.0324 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9706    2.8531   -0.9595 C   0  0  0  0  0  2  0  0  0  0  0  0
   18.2506    4.6051   -2.6626 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4074    6.0315   -2.5727 C   0  0  0  0  0  3  0  0  0  0  0  0
   18.3332    5.2603   -0.5540 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4456    6.4009   -1.4395 C   0  0  0  0  0  3  0  0  0  0  0  0
   10.3257   -1.7320   -1.4045 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2333   -1.4087    2.4269 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1790   -4.8717    1.2005 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1534   -3.2703   -2.0968 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8923   -2.2036   -0.2635 N   0  0  0  0  0  2  0  0  0  0  0  0
  -17.8477    7.3060   -0.4863 N   0  0  0  0  0  1  0  0  0  0  0  0
    1.2271    0.6839   -0.7316 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2322    0.9420    1.6428 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.1083   -1.5056    1.9282 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3879   -0.0747   -0.9377 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7629    2.2920   -0.1264 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3013    0.3625    3.2711 O   0  0  0  0  0  0  0  0  0  0  0  0
  -20.2996   -1.3467   -0.6747 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.7696   -3.4178   -1.0734 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.1298   -0.8579   -0.3227 N   0  0  0  0  0  2  0  0  0  0  0  0
  -11.5232   -2.1427   -0.7448 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.2260    4.0171   -3.7314 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.6881   -2.8433    0.7694 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1727    4.1388   -1.3573 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.3847    5.3663    0.6615 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0628   -1.4857   -1.0674 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  1  3  1  0
  2  7  1  0
  3 48  1  0
  4  5  1  0
  4 49  1  0
  5 48  1  0
  6  7  2  0
  6 10  1  0
  6 47  1  0
  8  9  1  0
  8 49  1  0
  9 50  1  0
 10 51  1  0
 11 12  1  0
 11 53  1  0
 12 50  1  0
 13 14  1  0
 13 53  1  0
 14 54  1  0
 15 21  1  0
 15 52  1  0
 16 17  1  0
 16 56  1  0
 17 54  1  0
 18 24  1  0
 18 51  1  0
 18 55  2  0
 19 22  1  0
 19 56  1  0
 20 29  1  0
 21 23  1  0
 22 57  1  0
 23 31  1  0
 24 26  1  0
 24 30  1  0
 25 27  1  0
 25 58  1  0
 26 33  1  0
 27 57  1  0
 28 34  1  0
 28 58  1  0
 29 35  1  0
 29 59  2  0
 30 39  1  0
 32 34  1  0
 32 37  1  0
 33 40  1  0
 35 31  1  0
 35 61  1  0
 36 37  1  0
 36 60  1  0
 37 62  2  0
 38 41  1  0
 38 60  1  0
 39 40  1  0
 40 42  1  0
 41 61  1  0
 41 64  2  0
 42 65  1  0
 43 44  1  0
 43 63  2  0
 43 65  1  0
 44 46  2  0
 45 46  1  0
 45 65  1  0
 45 66  2  0
 47 67  2  0
 67  2  1  0
M  RAD  8   1   3   3   3   4   3   5   3   7   2   8   3   9   3  10   3
M  RAD  8  11   3  12   3  13   3  14   3  15   3  16   3  17   3  19   3
M  RAD  8  20   2  21   3  22   3  23   3  24   2  25   3  26   3  27   3
M  RAD  8  28   3  30   3  31   3  32   2  33   3  34   3  35   2  36   3
M  RAD  8  38   3  39   3  40   2  42   3  44   2  46   2  51   2  52   3
M  RAD  1  61   2
M  END
$$$$
