
     RDKit          3D

 69 71  0  0  0  0  0  0  0  0999 V2000
   -3.7885   -4.3752    0.0413 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7578   -3.4501   -0.6225 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0473   -3.3523   -2.1282 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7717   -2.0629    0.0685 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5454   -1.1749   -0.2613 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3151   -0.2047    0.8153 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2108   -0.3144    1.7230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4366   -0.7573    2.8827 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1743    0.2430    1.4000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3144    1.6616    2.0687 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4953    2.8216    1.4506 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8915    3.0085    2.0976 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8646    3.8036    1.2000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8751    2.9624    0.6692 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4914    2.4491   -0.5914 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4492    1.3136   -1.0034 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7243    1.8833   -1.6358 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7815    0.3994   -1.9401 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6806   -0.4678   -1.5987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8025   -0.6881   -2.4763 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2431   -0.7181    2.0267 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5946   -0.7331    1.2788 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8204    0.5474    0.5875 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2204    0.7465    0.1549 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7203   -0.3206   -0.7857 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3159   -1.5025   -0.3503 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7137   -2.4021   -1.7117 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.1225   -1.2597   -2.7922 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6195   -0.1914   -2.1371 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8396    0.7923   -0.4931 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4313    0.2732   -0.1344 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7623   -5.3824   -0.4262 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8135   -3.9570   -0.0615 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5576   -4.4987    1.1210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7570   -3.9181   -0.4863 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9661   -2.7563   -2.3163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1853   -4.3654   -2.5632 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1927   -2.8902   -2.6599 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7695   -2.2336    1.1682 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7206   -1.5366   -0.1647 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6610   -1.8477   -0.3157 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1597    0.2459    1.2257 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0716    1.5865    3.1525 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3793    1.9732    2.0446 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4298    2.7303    0.3549 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0594    3.7663    1.6171 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3443    2.0384    2.3733 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7513    3.5574    3.0550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3302    4.3942    0.4179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3731    4.5599    1.8352 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5029    3.2583   -1.3564 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4629    2.0415   -0.5544 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7800    0.7487   -0.1113 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2432    2.5512   -0.9155 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4134    1.0548   -1.9054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4855    2.4613   -2.5541 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9681    0.5284   -2.9604 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8663   -1.7662    2.0288 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4179   -0.4533    3.0933 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5982   -1.5686    0.5422 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4056   -0.9245    2.0157 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3191    1.7392   -0.3363 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8772    0.7828    1.0510 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4896   -1.7926    0.6774 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1351   -1.3499   -3.8695 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1551    0.3131   -1.4441 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7792    1.8877   -0.6720 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6696    0.8574   -0.6845 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3559   -0.7656   -0.5230 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 19 20  2  0
  9 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  1  0
 28 29  2  0
 23 30  1  0
 30 31  1  0
 19  5  1  0
 29 25  1  0
 31  9  1  0
  1 32  1  0
  1 33  1  0
  1 34  1  0
  2 35  1  0
  3 36  1  0
  3 37  1  0
  3 38  1  0
  4 39  1  0
  4 40  1  0
  5 41  1  0
  6 42  1  0
 10 43  1  0
 10 44  1  0
 11 45  1  0
 11 46  1  0
 12 47  1  0
 12 48  1  0
 13 49  1  0
 13 50  1  0
 15 51  1  0
 15 52  1  0
 16 53  1  0
 17 54  1  0
 17 55  1  0
 17 56  1  0
 18 57  1  0
 21 58  1  0
 21 59  1  0
 22 60  1  0
 22 61  1  0
 24 62  1  0
 24 63  1  0
 26 64  1  0
 28 65  1  0
 30 66  1  0
 30 67  1  0
 31 68  1  0
 31 69  1  0
M  END
$$$$
