SIAL-ZINC04566941
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.4250    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6070   -0.6080   -1.0570 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1570    0.1300   -2.0460 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7540   -0.4590   -3.0920 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8340   -1.7890   -3.2080 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3110   -2.6010   -2.2670 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6740   -2.0260   -1.1390 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1930   -2.7290   -0.2640 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5190   -2.3890   -4.4090 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7600   -2.0600   -5.6180 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2470   -1.4740   -6.4440 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.7340   -0.8880   -7.2710 N   0  5  0  0  0  0  0  0  0  0  0  0
    1.0050    1.8020    0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5440    1.7860   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5280    1.7760    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1160    1.2080   -1.9930 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3800   -3.6740   -2.3700 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5280   -1.9850   -4.4910 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5690   -3.4720   -4.2950 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  8  1  0  0  0  0
  4  5  1  0  0  0  0
  4 17  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 10  1  0  0  0  0
  7  8  1  0  0  0  0
  7 18  1  0  0  0  0
  8  9  2  0  0  0  0
 10 11  1  0  0  0  0
 10 19  1  0  0  0  0
 10 20  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  2  0  0  0  0
M  CHG  1  12   1
M  CHG  1  13  -1
M  END