PUBCHEM-ZINC05567046
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
    0.0020    1.4250   -0.0280 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020    0.0520   -0.2860 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2050   -0.6570   -0.2610 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3850    0.0010    0.0170 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3790    1.3620    0.2720 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1880    2.0720    0.2490 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1910    3.9310    0.5970 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.8680    2.1830    0.6220 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.2140   -2.1120   -0.5330 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.7710   -2.8720    0.2390 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6640   -2.5490   -1.5280 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.2640   -0.6470   -0.5830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2800   -1.8570   -0.6880 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9250    1.9790   -0.0500 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3160   -0.5460    0.0360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4020    0.0580   -0.7360 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2060   -0.4440   -0.9300 H   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 12  1  0  0  0  0
  3  4  1  0  0  0  0
  3  9  1  0  0  0  0
  4  5  2  0  0  0  0
  4 15  1  0  0  0  0
  5  6  1  0  0  0  0
  5  8  1  0  0  0  0
  6  7  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 12 13  2  0  0  0  0
 12 16  1  0  0  0  0
 16 17  1  0  0  0  0
M  CHG  1   9   1
M  CHG  1  11  -1
M  END