ENAMINE-ZINC06549589
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 30 31  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.3780    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2080   -0.6790   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3960    0.0290   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3770    1.4110   -0.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1710    2.0860    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6490    2.1680   -0.0220 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.7120    1.5740   -0.0340 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6320    3.3860   -0.0160 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.2290   -2.1860   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2200   -2.7820   -1.7340 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.2460   -4.5340   -1.5430 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2660   -5.0960   -0.2730 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2860   -6.4690   -0.1270 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2860   -7.2850   -1.2450 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2650   -6.7280   -2.5110 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2400   -5.3560   -2.6640 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2130   -4.7610   -4.0190 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.2080   -5.4820   -5.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1950   -3.5500   -4.1520 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.3110   -9.0110   -1.0580 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.9590    1.9060    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9260   -0.5570    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3380   -0.4980   -0.0320 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1560    3.1660    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1290   -2.5390    0.4830 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3490   -2.5630    0.5000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2660   -4.4600    0.6000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3010   -6.9060    0.8600 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2660   -7.3670   -3.3820 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 22  1  0  0  0  0
  2  3  2  0  0  0  0
  2 23  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 24  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6 25  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 10 11  1  0  0  0  0
 10 26  1  0  0  0  0
 10 27  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 17  2  0  0  0  0
 13 14  2  0  0  0  0
 13 28  1  0  0  0  0
 14 15  1  0  0  0  0
 14 29  1  0  0  0  0
 15 16  2  0  0  0  0
 15 21  1  0  0  0  0
 16 17  1  0  0  0  0
 16 30  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  CHG  1  18   1
M  CHG  1  20  -1
M  END