A1DOL
  CCTOOLS-0731261037

 33 35  0  0  1  0  0  0  0  0999 V2000
    1.6820   -1.8020   -0.3030 BR  0  0  0  0  0
    2.0680   -0.0070    0.1540 C   0  0  0  0  0
    3.3070    0.3230    0.6720 C   0  0  0  0  0
    3.5890    1.6350    1.0060 C   0  0  0  0  0
    2.6320    2.6160    0.8220 C   0  0  0  0  0
    1.3940    2.2860    0.3040 C   0  0  0  0  0
    1.1130    0.9750   -0.0360 C   0  0  0  0  0
   -0.2360    0.6150   -0.6010 C   0  0  0  0  0
   -1.1510    0.1340    0.5280 C   0  0  0  0  0
   -2.4780   -0.1790   -0.0200 N   0  0  0  0  0
   -3.3640   -0.7170    1.0210 C   0  0  0  0  0
   -4.6670    0.0360    1.2990 C   0  0  0  0  0
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   -0.8320    1.7980   -1.2390 N   0  0  0  0  0
    4.0550   -0.4430    0.8170 H   0  0  0  0  0
    4.5560    1.8930    1.4110 H   0  0  0  0  0
    2.8500    3.6390    1.0880 H   0  0  0  0  0
    0.6460    3.0520    0.1610 H   0  0  0  0  0
   -0.1220   -0.1780   -1.3390 H   0  0  0  0  0
   -0.7250   -0.7600    0.9840 H   0  0  0  0  0
   -1.2430    0.9170    1.2800 H   0  0  0  0  0
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   -2.0660    0.7010   -2.5390 H   0  0  0  0  0
   -2.5840    2.3790   -2.2430 H   0  0  0  0  0
   -0.2230    2.1670   -1.9540 H   0  0  0  0  0
  2  1  1  0  0  0
  3  2  1  0  0  0
  3 17  1  0  0  0
  4  3  2  0  0  0
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  5  6  2  0  0  0
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  6  7  1  0  0  0
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  7  8  1  0  0  0
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  9 23  1  0  0  0
 10  9  1  0  0  0
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 16  8  1  0  0  0
 16 33  1  0  0  0
M  END
$$$$
