OQB
  CCTOOLS-1004241129

 59 62  0  0  1  0  0  0  0  0999 V2000
   10.2100    0.3090    2.1270 O   0  0  0  0  0
    9.4150    0.0470    1.0780 C   0  0  0  0  0
    9.0080    0.9500    0.3870 O   0  0  0  0  0
    9.0310   -1.3760    0.7610 C   0  0  0  0  0
    8.1270   -1.3970   -0.4730 C   0  0  0  0  0
    7.8420   -2.8250   -0.8620 C   0  0  0  0  0
    6.7040   -3.2300   -0.8830 O   0  0  0  0  0
    6.8670   -0.7140   -0.1670 N   0  0  0  0  0
    6.1420   -0.1620   -1.1600 C   0  0  0  0  0
    6.5320   -0.2320   -2.3090 O   0  0  0  0  0
    4.8710    0.5270   -0.8520 C   0  0  0  0  0
    4.4090    0.6090    0.4620 C   0  0  0  0  0
    3.2790    1.2280    0.7370 N   0  0  0  0  0
    4.1080    1.1050   -1.8740 C   0  0  0  0  0
    2.9260    1.7380   -1.5330 C   0  0  0  0  0
    2.5400    1.7810   -0.2050 C   0  0  0  0  0
    1.2540    2.4700    0.1710 C   0  0  0  0  0
    0.1750    1.4820    0.2490 N   0  0  0  0  0
   -1.0740    1.8720    0.5710 C   0  0  0  0  0
   -1.3060    3.0440    0.7980 O   0  0  0  0  0
   -2.1610    0.8770    0.6490 C   0  0  0  0  0
   -3.4570    1.2800    0.9840 C   0  0  0  0  0
   -1.8980   -0.4690    0.3830 C   0  0  0  0  0
   -2.9120   -1.3960    0.4620 C   0  0  0  0  0
   -4.2020   -0.9910    0.7960 C   0  0  0  0  0
   -4.4680    0.3500    1.0550 C   0  0  0  0  0
   -5.2270   -1.9300    0.8690 N   0  0  0  0  0
   -6.5200   -1.5740    0.5110 C   0  0  0  0  0
   -7.5720   -2.4880    0.7010 C   0  0  0  0  0
   -8.8000   -2.1700    0.3690 N   0  0  0  0  0
   -6.7540   -0.3800    0.0010 N   0  0  0  0  0
   -8.0010   -0.0410   -0.3480 C   0  0  0  0  0
   -9.0580   -0.9650   -0.1550 C   0  0  0  0  0
   -8.2810    1.2200   -0.8990 C   0  0  0  0  0
   -9.5600    1.5400   -1.2390 C   0  0  0  0  0
  -10.5990    0.6320   -1.0500 C   0  0  0  0  0
  -10.3650   -0.6000   -0.5190 C   0  0  0  0  0
   10.4570    1.2220    2.3300 H   0  0  0  0  0
    9.9290   -1.9600    0.5630 H   0  0  0  0  0
    8.4980   -1.8050    1.6100 H   0  0  0  0  0
    8.6250   -0.8880   -1.2970 H   0  0  0  0  0
    8.6550   -3.4860   -1.1230 H   0  0  0  0  0
    6.5550   -0.6580    0.7500 H   0  0  0  0  0
    4.9860    0.1690    1.2610 H   0  0  0  0  0
    4.4330    1.0570   -2.9030 H   0  0  0  0  0
    2.3120    2.1950   -2.2950 H   0  0  0  0  0
    1.3720    2.9560    1.1390 H   0  0  0  0  0
    1.0080    3.2180   -0.5830 H   0  0  0  0  0
    0.3590    0.5470    0.0680 H   0  0  0  0  0
   -3.6640    2.3210    1.1860 H   0  0  0  0  0
   -0.8970   -0.7840    0.1250 H   0  0  0  0  0
   -2.7090   -2.4370    0.2610 H   0  0  0  0  0
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   -7.3670   -3.4600    1.1240 H   0  0  0  0  0
   -7.4840    1.9340   -1.0520 H   0  0  0  0  0
   -9.7710    2.5110   -1.6630 H   0  0  0  0  0
  -11.6050    0.9100   -1.3280 H   0  0  0  0  0
  -11.1810   -1.2930   -0.3780 H   0  0  0  0  0
  1  2  1  0  0  0
  1 38  1  0  0  0
  2  3  2  0  0  0
  2  4  1  0  0  0
  4  5  1  0  0  0
  4 39  1  0  0  0
  4 40  1  0  0  0
  5  6  1  0  0  0
  5  8  1  0  0  0
  5 41  1  0  0  0
  6  7  2  0  0  0
  6 42  1  0  0  0
  8  9  1  0  0  0
  8 43  1  0  0  0
  9 10  2  0  0  0
  9 11  1  0  0  0
 11 12  2  0  0  0
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 35 36  1  0  0  0
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 36 37  2  0  0  0
 36 58  1  0  0  0
 37 59  1  0  0  0
M  END
$$$$
