3BI
  CCTOOLS-0919241043

 74 76  0  0  1  0  0  0  0  0999 V2000
   11.4220    1.0390   -1.3150 N   0  0  0  0  0
    8.2480   -1.2640   -0.1780 C   0  0  0  0  0
    9.1760   -3.0570   -1.6120 N   0  0  0  0  0
    6.4820   -0.1830    1.5260 C   0  0  0  0  0
    7.5060    0.5570    1.1560 N   0  0  0  0  0
    5.1460   -2.3060    1.4810 C   0  0  0  0  0
    3.9970   -3.1200   -0.6300 C   0  0  0  0  0
    2.2530    0.7130    1.8200 C   0  0  0  0  0
    3.1210   -1.1750    0.6220 C   0  0  0  0  0
    2.1000   -1.0590   -0.3180 C   0  0  0  0  0
    1.1580   -0.0630   -0.1940 C   0  0  0  0  0
    0.2190    1.9000    1.0140 C   0  0  0  0  0
   -1.7710    3.0750    0.2410 C   0  0  0  0  0
   -1.2480    4.3420   -0.3830 C   0  0  0  0  0
   10.3490    0.2550   -0.9340 C   0  0  0  0  0
    0.2800    2.6780    1.9470 O   0  0  0  0  0
    9.4690    0.7660   -0.0970 N   0  0  0  0  0
   -2.0000    5.4540   -0.3760 O   0  0  0  0  0
   -0.1510    4.3590   -0.8890 O   0  0  0  0  0
   -6.1180    2.0890   -0.6710 O   0  0  0  0  0
   -5.1950    0.9340   -0.5980 P   0  0  0  0  0
   -4.8490    0.4280   -2.0860 O   0  0  0  0  0
   -5.9850   -0.4170    0.3360 C   0  0  0  0  0
   -7.3350   -0.7550   -0.3010 C   0  0  0  0  0
   -8.3370    0.3140    0.0490 C   0  0  0  0  0
   -8.0060    1.2510    0.7370 O   0  0  0  0  0
   -9.5980    0.2270   -0.4040 O   0  0  0  0  0
   -7.8240   -2.1050    0.2270 C   0  0  0  0  0
   -9.1100   -2.5020   -0.5010 C   0  0  0  0  0
   -9.5920   -3.8310    0.0200 C   0  0  0  0  0
  -10.7120   -4.3800   -0.4770 O   0  0  0  0  0
   -8.9710   -4.4030    0.8840 O   0  0  0  0  0
   -3.6580    1.4370    0.2450 C   0  0  0  0  0
   -3.0600    2.6520   -0.4670 C   0  0  0  0  0
   -0.7700    2.0140    0.1050 N   0  0  0  0  0
    1.2270    0.8320    0.8780 C   0  0  0  0  0
    3.1920   -0.2850    1.6900 C   0  0  0  0  0
    4.0710   -2.1820    0.4930 N   0  0  0  0  0
    6.3280   -1.4810    1.0420 C   0  0  0  0  0
    7.2060   -1.9940    0.2070 N   0  0  0  0  0
    8.4090    0.0560    0.3100 C   0  0  0  0  0
    9.2620   -1.7810   -1.1000 C   0  0  0  0  0
   10.2640   -0.9770   -1.4260 N   0  0  0  0  0
   11.5110    1.9400   -0.9680 H   0  0  0  0  0
   12.0870    0.6870   -1.9270 H   0  0  0  0  0
    8.4340   -3.6310   -1.3630 H   0  0  0  0  0
    9.8570   -3.3820   -2.2220 H   0  0  0  0  0
    5.7520    0.2210    2.2110 H   0  0  0  0  0
    4.7930   -1.9490    2.4480 H   0  0  0  0  0
    5.4430   -3.3510    1.5660 H   0  0  0  0  0
    3.3890   -3.9800   -0.3460 H   0  0  0  0  0
    3.5450   -2.6240   -1.4880 H   0  0  0  0  0
    2.3120    1.4060    2.6460 H   0  0  0  0  0
    2.0470   -1.7510   -1.1450 H   0  0  0  0  0
    0.3670    0.0260   -0.9230 H   0  0  0  0  0
   -1.9760    3.2470    1.2980 H   0  0  0  0  0
   -5.3430   -1.2980    0.3140 H   0  0  0  0  0
   -6.1390   -0.1050    1.3680 H   0  0  0  0  0
   -7.2230   -0.8080   -1.3840 H   0  0  0  0  0
   -7.0600   -2.8620    0.0530 H   0  0  0  0  0
   -8.0210   -2.0270    1.2960 H   0  0  0  0  0
   -9.8750   -1.7450   -0.3260 H   0  0  0  0  0
   -8.9130   -2.5800   -1.5700 H   0  0  0  0  0
   -3.8800    1.6960    1.2810 H   0  0  0  0  0
   -2.9440    0.6140    0.2210 H   0  0  0  0  0
   -3.7740    3.4760   -0.4420 H   0  0  0  0  0
   -2.8390    2.3940   -1.5020 H   0  0  0  0  0
   -0.8180    1.3930   -0.6390 H   0  0  0  0  0
    3.9850   -0.3770    2.4170 H   0  0  0  0  0
  -10.9820   -5.2340   -0.1120 H   0  0  0  0  0
   -4.2470   -0.3280   -2.1150 H   0  0  0  0  0
   -1.6220    6.2430   -0.7890 H   0  0  0  0  0
  -10.2050    0.9370   -0.1530 H   0  0  0  0  0
    5.0010   -3.4550   -0.8900 H   0  0  0  0  0
  1 15  1  0  0  0
  1 44  1  0  0  0
  1 45  1  0  0  0
  2 40  2  0  0  0
  2 41  1  0  0  0
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  3 46  1  0  0  0
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  4  5  1  0  0  0
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  7 74  1  0  0  0
  8 36  2  0  0  0
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  8 53  1  0  0  0
  9 10  1  0  0  0
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 10 11  2  0  0  0
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 39 40  1  0  0  0
 42 43  2  0  0  0
M  END
$$$$
