A1CLN
  CCTOOLS-0116261005

 58 62  0  0  0  0  0  0  0  0999 V2000
    5.1180    1.4570    0.4460 C   0  0  0  0  0
    7.6200    1.6840   -0.5960 C   0  0  0  0  0
    1.4260   -1.6500    1.0500 C   0  0  0  0  0
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   -2.0230   -0.0240   -0.3280 C   0  0  0  0  0
   -1.1160   -1.0690   -0.3920 C   0  0  0  0  0
    1.1750   -1.7550   -0.4560 C   0  0  0  0  0
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    2.9290   -0.0140   -0.8110 C   0  0  0  0  0
    3.7390    1.3220    1.0380 C   0  0  0  0  0
    5.2850    2.1300   -0.7490 C   0  0  0  0  0
    6.5580    2.2490   -1.2860 C   0  0  0  0  0
    7.3760    1.0300    0.5970 C   0  0  0  0  0
    1.9220   -0.2400    1.3820 C   0  0  0  0  0
    0.7460   -3.1870   -0.8000 C   0  0  0  0  0
   -0.5480   -3.4600   -0.0530 C   0  0  0  0  0
   -3.7150   -1.5430    0.5010 C   0  0  0  0  0
   -4.2910    0.8600    0.1870 C   0  0  0  0  0
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   -5.5650    0.7430   -0.3780 C   0  0  0  0  0
    3.1580    0.0330    0.6390 N   0  0  0  0  0
    6.1520    0.9370    1.0780 N   0  0  0  0  0
   -6.0850    2.9230    0.3230 N   0  0  0  0  0
    0.1440   -0.8450   -0.8350 O   0  0  0  0  0
   -0.7680   -4.5320    0.4710 O   0  0  0  0  0
    8.6250    1.7570   -0.9840 H   0  0  0  0  0
    0.4990   -1.8460    1.5890 H   0  0  0  0  0
    2.1800   -2.3790    1.3460 H   0  0  0  0  0
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    3.2350   -2.1430   -0.9530 H   0  0  0  0  0
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    3.8560    0.2230   -1.3330 H   0  0  0  0  0
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    3.8030    1.3710    2.1250 H   0  0  0  0  0
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    4.4350    2.5580   -1.2590 H   0  0  0  0  0
    6.7190    2.7690   -2.2180 H   0  0  0  0  0
    8.1980    0.5870    1.1400 H   0  0  0  0  0
    1.1610    0.4880    1.1010 H   0  0  0  0  0
    2.1170   -0.1660    2.4520 H   0  0  0  0  0
    0.5810   -3.2780   -1.8730 H   0  0  0  0  0
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   -8.5120    2.3020   -0.3150 H   0  0  0  0  0
   -5.8620   -0.1690   -0.8760 H   0  0  0  0  0
  1 14  1  0  0  0
  1 28  1  0  0  0
  2 16  2  0  0  0
  2 32  1  0  0  0
  3 18  1  0  0  0
  3 33  1  0  0  0
  3 34  1  0  0  0
  4 10  1  0  0  0
  5  4  2  0  0  0
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  6 21  2  0  0  0
  7 22  2  0  0  0
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  8 37  1  0  0  0
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  9  8  1  0  0  0
  9  6  1  0  0  0
 10  9  2  0  0  0
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 11  3  1  0  0  0
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 28 17  2  0  0  0
 29 23  2  0  0  0
 30 10  1  0  0  0
 31 20  2  0  0  0
M  END
$$$$
