
     RDKit          3D

 75 78  0  0  0  0  0  0  0  0999 V2000
    1.6985    3.7808    0.2027 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2107    2.3940    0.6038 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0787    1.3475    0.0516 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3081    1.0087    0.7857 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0538   -0.1973    1.6907 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2611   -0.7369    2.2353 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4038   -1.1054    1.5059 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6152   -0.5110    1.8855 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7996   -0.8054    1.2102 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7911   -1.7093    0.1495 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6010   -2.3339   -0.2272 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3984   -2.0590    0.4497 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1510   -2.7755   -0.0059 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5491   -2.0685   -1.2351 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0342   -2.2895   -1.3667 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3822   -1.3196   -2.3809 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7832    0.0129   -1.8165 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2759   -0.3383   -0.7143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4219    0.5813   -0.6577 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3328    0.4586    0.4535 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8788    0.2598    1.6138 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8262    0.5010    0.2593 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4525   -0.6862    0.8860 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2724   -1.8821    0.0405 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8822   -0.5153    1.2629 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8060   -0.0591    0.1177 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8084    0.8789    0.7632 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0614    1.5303    1.9150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0731    0.4864    2.4144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7656    1.4612   -1.7796 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5403    1.7920   -2.6145 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1609    0.6157   -2.9469 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9313    0.9140   -1.3199 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7953    1.2884   -2.1603 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7033    3.9738    0.6301 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7550    3.8662   -0.9044 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9948    4.5489    0.5874 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1892    2.3199    1.7134 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1728    2.2659    0.2590 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6319    1.8616    1.4195 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1358    0.8109    0.0772 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4079    0.1283    2.5336 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4859   -0.9645    1.1571 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6324    0.2020    2.7004 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7253   -0.3283    1.5072 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7111   -1.9313   -0.3759 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6181   -3.0399   -1.0486 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4357   -2.8717    0.8337 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4037   -3.8219   -0.2852 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7636   -0.9851   -1.1913 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0526   -2.4497   -2.1537 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5298   -2.2346   -0.3852 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8789   -3.3288   -1.7315 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5556   -1.8776   -2.8792 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1022   -1.0931   -3.2001 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6930   -1.3554   -0.8945 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2183   -0.3797    0.2804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1983    1.4463    0.7089 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0691    0.5408   -0.8223 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6377   -2.7863    0.5748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8202   -1.7806   -0.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1962   -2.0452   -0.1765 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2737   -1.4930    1.6319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2710    0.4968   -0.6752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3184   -0.9270   -0.3503 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1835    1.6377    0.0398 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6678    0.2934    1.1580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5062    2.4175    1.5390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7610    1.8488    2.7189 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1240    0.9607    2.7433 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5093   -0.0333    3.2957 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1909    2.4153   -1.3914 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5174    0.9616   -2.4323 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1021    2.5381   -2.1061 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8781    2.2737   -3.5563 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  2  0
 20 22  1  0
 22 23  1  0
 23 24  1  0
 23 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 19 30  1  0
 30 31  1  0
 31 32  1  0
 17 33  1  0
 33 34  2  0
 33  3  1  0
 12  7  1  0
 32 17  1  0
 29 25  1  0
  1 35  1  0
  1 36  1  0
  1 37  1  0
  2 38  1  0
  2 39  1  0
  4 40  1  0
  4 41  1  0
  5 42  1  0
  5 43  1  0
  8 44  1  0
  9 45  1  0
 10 46  1  0
 11 47  1  0
 13 48  1  0
 13 49  1  0
 14 50  1  0
 14 51  1  0
 15 52  1  0
 15 53  1  0
 16 54  1  0
 16 55  1  0
 18 56  1  0
 18 57  1  0
 22 58  1  0
 22 59  1  0
 24 60  1  0
 24 61  1  0
 24 62  1  0
 25 63  1  0
 26 64  1  0
 26 65  1  0
 27 66  1  0
 27 67  1  0
 28 68  1  0
 28 69  1  0
 29 70  1  0
 29 71  1  0
 30 72  1  0
 30 73  1  0
 31 74  1  0
 31 75  1  0
M  END
$$$$
