
     RDKit          3D

 61 63  0  0  0  0  0  0  0  0999 V2000
   -1.6516    4.9939   -0.5226 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8150    3.9566    0.4367 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2387    2.6906    0.2890 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5246    2.4325   -0.7186 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5032    1.6448    1.3405 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.9451    1.0959    1.2234 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2333   -0.2452    2.4357 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6723   -1.0006    1.5986 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3353   -1.6682    0.2778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0360   -1.2503   -0.8680 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8459   -1.8792   -2.0959 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9670   -2.9492   -2.1988 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2553   -3.3785   -1.0808 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3977   -2.7316    0.1580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6065   -3.2266    1.3110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2050   -3.4963    2.3826 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2196   -3.4611    1.2559 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2922   -2.9948    0.2660 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3594   -1.6646    0.6978 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.6619   -1.5066    0.0440 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6748   -0.6247    0.5492 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4593    0.0634    1.5852 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9947   -0.4986   -0.1650 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.1765   -0.8161    0.7545 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2058    0.2871    0.5144 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4584    1.4319   -0.1522 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2027    0.8684   -0.6201 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3612    1.5070   -1.5976 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6153    2.9181   -2.0331 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4214    0.8598   -2.1352 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5465   -0.4554    0.3540 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4380    0.6089    1.3733 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1935    5.8964   -0.1731 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5749    5.2391   -0.6347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0685    4.6778   -1.5034 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4585    2.1856    2.3132 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6647    1.9117    1.4413 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1423    0.7593    0.1842 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1134   -1.7519    2.2766 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4398   -0.2161    1.4685 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7483   -0.4423   -0.8101 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4019   -1.5527   -2.9649 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8454   -3.4572   -3.1442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5978   -4.2297   -1.1812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7401   -2.9049   -0.7425 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5040   -3.7687    0.1911 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5250   -1.7427    1.7945 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8588   -2.0445   -0.8294 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0251   -1.1781   -1.0446 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8829   -0.8146    1.8269 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6067   -1.8109    0.5115 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9955   -0.0867   -0.1710 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6728    0.6131    1.4663 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2561    2.2528    0.5687 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0550    1.8171   -1.0087 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4864    2.9347   -2.7238 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7281    3.3257   -2.5629 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8252    3.5601   -1.1501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2622   -0.0514   -0.6415 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5834   -0.8111    0.2544 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4498    0.1789    2.3293 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  2  0
 21 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 28 30  2  0
 19 31  1  0
 31 32  1  0
 32  5  1  0
 14  9  1  0
 27 23  1  0
  1 33  1  0
  1 34  1  0
  1 35  1  0
  5 36  1  1
  6 37  1  0
  6 38  1  0
  8 39  1  0
  8 40  1  0
 10 41  1  0
 11 42  1  0
 12 43  1  0
 13 44  1  0
 18 45  1  0
 18 46  1  0
 19 47  1  1
 20 48  1  0
 23 49  1  6
 24 50  1  0
 24 51  1  0
 25 52  1  0
 25 53  1  0
 26 54  1  0
 26 55  1  0
 29 56  1  0
 29 57  1  0
 29 58  1  0
 31 59  1  0
 31 60  1  0
 32 61  1  0
M  END
$$$$
