L1SA8X
  -OEChem-05032301173D

 78 83  0     0  0  0  0  0  0999 V2000
    5.4731    1.3879    4.7771 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.2560   -0.3423   -1.5970 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6990   -0.0266    0.3984 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5132   -6.1637   -0.3718 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1850    0.5140   -0.7464 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.2561   -0.0145   -3.3413 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1298   -0.2962    1.4692 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6951    1.0786    1.4955 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6460    0.5812    2.4638 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0273    1.6355   -1.2914 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2215    1.7709    0.3023 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9421   -3.7685    0.6968 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0666    4.1290    0.4971 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6931    3.8825   -0.6660 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.9839   -0.7973   -1.3692 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3215    1.2977   -1.2449 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0317   -0.6868   -2.8948 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3241    1.3365   -2.7745 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7714    0.7227    0.5748 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3112    0.0370   -4.8018 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4253    0.5486    0.8537 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5111   -0.2987   -0.0264 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4487   -1.5834    0.5568 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5282    0.4764    0.5526 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    0.7521    2.1617 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2787    0.1430    2.3385 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4232   -1.5540    1.4801 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2372   -2.7571    0.3195 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3612    0.2857   -1.0405 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6045    0.2155    1.5974 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9208    1.1183    3.1373 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2444    1.2677    2.7561 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6254   -3.9311   -0.1202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9886    2.2910   -0.6112 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6159   -2.7252    0.5284 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3926   -5.0730   -0.3512 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7962    2.3605   -2.2904 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3830   -3.8670    0.2974 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7713   -5.0409   -0.1423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7188   -6.3196   -0.8227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1025    2.7485   -1.7611 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7962   -3.8127    0.5181 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1765    3.0689   -1.3285 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4548    3.4500   -0.8115 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7248    3.8859    0.4629 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7035    3.4678   -1.4614 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8219    4.6051    1.6310 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7666   -1.4827   -1.0188 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0219   -1.2409   -1.0889 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2697    2.3295   -0.8752 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2583    0.8583   -0.8787 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9861   -1.6998   -3.3128 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1428   -0.1476   -3.2494 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4796    1.9452   -3.1253 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2435    1.8365   -3.1028 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2445    0.5045   -5.1348 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2998   -0.9746   -5.2226 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4725    0.5981   -5.2297 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7733    0.2892    0.0351 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3405   -0.5795    3.1589 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0027    1.1259    2.7338 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0386   -2.3174    2.1444 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3980    0.7460    3.4372 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0126    1.5523    3.4690 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5507   -3.9586   -0.2893 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8510    3.3417   -0.9114 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0958   -1.8118    0.8768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9280    1.7126   -3.1646 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2418    3.2477   -2.6144 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8771   -7.1320   -0.1057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1141   -6.6194   -1.7988 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6374   -6.1849   -0.9329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4526   -6.0036   -0.1883 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0913    4.0393    1.3264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9379    3.1965   -2.4813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2890    5.5549    1.3588 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1518    4.7489    2.4821 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5817    3.8587    1.8760 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 31  1  0  0  0  0
  2 29  2  0  0  0  0
  3 30  2  0  0  0  0
  4 39  1  0  0  0  0
  4 73  1  0  0  0  0
  5 15  1  0  0  0  0
  5 16  1  0  0  0  0
  5 19  1  0  0  0  0
  6 17  1  0  0  0  0
  6 18  1  0  0  0  0
  6 20  1  0  0  0  0
  7 24  1  0  0  0  0
  7 26  1  0  0  0  0
  7 27  1  0  0  0  0
  8 19  2  0  0  0  0
  8 32  1  0  0  0  0
  9 25  1  0  0  0  0
  9 30  1  0  0  0  0
  9 63  1  0  0  0  0
 10 29  1  0  0  0  0
 10 34  1  0  0  0  0
 10 37  1  0  0  0  0
 11 24  1  0  0  0  0
 11 34  2  0  0  0  0
 12 42  3  0  0  0  0
 13 14  1  0  0  0  0
 13 45  1  0  0  0  0
 13 47  1  0  0  0  0
 14 46  2  0  0  0  0
 15 17  1  0  0  0  0
 15 48  1  0  0  0  0
 15 49  1  0  0  0  0
 16 18  1  0  0  0  0
 16 50  1  0  0  0  0
 16 51  1  0  0  0  0
 17 52  1  0  0  0  0
 17 53  1  0  0  0  0
 18 54  1  0  0  0  0
 18 55  1  0  0  0  0
 19 21  1  0  0  0  0
 20 56  1  0  0  0  0
 20 57  1  0  0  0  0
 20 58  1  0  0  0  0
 21 25  2  0  0  0  0
 21 59  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  2  0  0  0  0
 22 29  1  0  0  0  0
 23 27  2  0  0  0  0
 23 28  1  0  0  0  0
 25 31  1  0  0  0  0
 26 30  1  0  0  0  0
 26 60  1  0  0  0  0
 26 61  1  0  0  0  0
 27 62  1  0  0  0  0
 28 33  1  0  0  0  0
 28 35  2  0  0  0  0
 31 32  2  0  0  0  0
 32 64  1  0  0  0  0
 33 36  2  0  0  0  0
 33 65  1  0  0  0  0
 34 66  1  0  0  0  0
 35 38  1  0  0  0  0
 35 67  1  0  0  0  0
 36 39  1  0  0  0  0
 36 40  1  0  0  0  0
 37 41  1  0  0  0  0
 37 68  1  0  0  0  0
 37 69  1  0  0  0  0
 38 39  2  0  0  0  0
 38 42  1  0  0  0  0
 40 70  1  0  0  0  0
 40 71  1  0  0  0  0
 40 72  1  0  0  0  0
 41 43  3  0  0  0  0
 43 44  1  0  0  0  0
 44 45  2  0  0  0  0
 44 46  1  0  0  0  0
 45 74  1  0  0  0  0
 46 75  1  0  0  0  0
 47 76  1  0  0  0  0
 47 77  1  0  0  0  0
 47 78  1  0  0  0  0
M  END

$$$$