IBS-ZINC00402742
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 19  0  0  0  0  0  0  0  0999 V2000
   -0.0360    1.3260   -0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0080   -0.0720   -0.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2680   -0.6820   -0.0170 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4630    0.0490   -0.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3960    1.4570   -0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1400    2.0740   -0.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0370    3.9660   -0.0020 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.5370   -0.8880   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9700   -2.1380   -0.0230 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6120   -2.0150   -0.0210 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9810   -2.8060   -0.0230 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6360   -3.4190   -0.0270 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9050   -3.4290   -0.0280 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.0040    1.8200   -0.0070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9040   -0.6600   -0.0150 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3100    2.0430   -0.0110 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5980   -0.6750   -0.0200 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8710   -4.4340   -0.0290 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 14  1  0  0  0  0
  2  3  2  0  0  0  0
  2 15  1  0  0  0  0
  3  4  1  0  0  0  0
  3 10  1  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  5  6  1  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  8  9  2  0  0  0  0
  8 17  1  0  0  0  0
  9 10  1  0  0  0  0
  9 12  1  0  0  0  0
 10 11  1  0  0  0  0
 12 13  1  0  0  0  0
 12 18  2  0  0  0  0
M  CHG  1  13  -1
M  END