PUBCHEM-ZINC04517807
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 30 30  0  0  1  0  0  0  0  0999 V2000
   -1.0170    1.4750    0.2300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7610   -0.0060    0.1690 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3950   -0.6910    1.3390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1620   -2.0750    1.3060 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2900   -2.7910    0.1120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6470   -2.1110   -1.0590 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8860   -0.7320   -1.0270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3220    0.0440   -2.5090 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0720   -4.5210    0.0020 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.0510   -4.8940   -1.3980 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2700   -4.7330    0.7890 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2430   -5.2610    0.7880 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5700   -5.2560    0.0820 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.4300   -5.4830   -0.9800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4410   -6.3360    0.7090 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3290   -3.9270    0.2690 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0790   -3.3180    1.3510 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1930   -2.7120    2.5660 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.1050   -2.1860    3.2200 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4550   -3.7090    2.9160 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.3260    2.0090   -0.4300 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0490    1.6960   -0.0600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8700    1.8660    1.2430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3040   -0.1440    2.2770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7530   -2.6480   -2.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3620   -4.8540    1.7390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9700   -7.3200    0.6080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6010   -6.1580    1.7790 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4240   -6.3810    0.2280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0780   -3.5910   -0.6900 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 21  1  0  0  0  0
  1 22  1  0  0  0  0
  1 23  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  2  0  0  0  0
  3  4  2  0  0  0  0
  3 24  1  0  0  0  0
  4  5  1  0  0  0  0
  4 18  1  0  0  0  0
  5  6  2  0  0  0  0
  5  9  1  0  0  0  0
  6  7  1  0  0  0  0
  6 25  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  2  0  0  0  0
  9 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 26  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 13 16  1  0  0  0  0
 15 27  1  0  0  0  0
 15 28  1  0  0  0  0
 15 29  1  0  0  0  0
 16 17  2  0  0  0  0
 16 30  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  1  18   1
M  CHG  1  20  -1
M  CHG  1  30  -1
M  END