ENAMINE-ZINC04219000
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 30 30  0  0  1  0  0  0  0  0999 V2000
   -0.2800    2.0650   -0.8110 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0110    0.3680   -0.2590 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.8730   -0.2560   -1.7410 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1440   -1.7530   -1.6020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7880   -2.3580   -2.8620 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.2090   -2.0990   -3.7550 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7380   -3.8990   -2.6510 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8330   -4.4090   -2.2640 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1670   -1.8850   -3.0470 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5350   -0.7690   -3.7590 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7270   -0.0500   -4.3430 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9580   -0.5020   -3.7540 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6890    0.4910   -4.3850 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0460    0.3030   -4.0240 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0490   -0.7920   -3.1960 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8020   -1.3000   -3.0200 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1070   -1.4540   -2.5080 N   0  3  0  0  0  0  0  0  0  0  0  0
    9.2410   -0.9770   -2.6600 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8230   -2.4390   -1.8170 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.6690    2.5660   -1.0200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9050    2.0720   -1.7080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7980    2.6170   -0.0230 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2500   -0.0650   -2.6200 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8080    0.3020   -1.8370 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7950   -1.9330   -0.7360 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1960   -2.2690   -1.3970 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8760   -2.4800   -2.6140 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2770    1.2600   -5.0260 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9000    0.8920   -4.3260 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6280   -4.4470   -2.9010 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 20  1  0  0  0  0
  1 21  1  0  0  0  0
  1 22  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3 23  1  0  0  0  0
  3 24  1  0  0  0  0
  4  5  1  0  0  0  0
  4 25  1  0  0  0  0
  4 26  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5  9  1  0  0  0  0
  7  8  2  0  0  0  0
  7 30  1  0  0  0  0
  9 10  1  0  0  0  0
  9 27  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 16  1  0  0  0  0
 13 14  1  0  0  0  0
 13 28  1  0  0  0  0
 14 15  2  0  0  0  0
 14 29  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  2  0  0  0  0
 17 19  1  0  0  0  0
M  CHG  1  17   1
M  CHG  1  19  -1
M  CHG  1  30  -1
M  END