NCID-ZINC05607323
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
    1.3130   -0.4240   -2.0820 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3070    0.5240   -2.2880 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8790    1.3710   -1.4790 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9640    2.7000   -1.8220 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5430    0.8130    0.0550 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.0080   -0.8660    0.0270 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9340   -1.8870    0.2080 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5000   -3.2010    0.1840 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1500   -3.4490   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2850   -2.3860   -0.1920 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7260   -1.1430   -0.1590 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.1920   -0.0790   -0.3340 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.5980    3.0070   -2.6660 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3890    3.3300   -1.2200 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9780   -1.6580    0.3630 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1970   -4.0150    0.3200 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7790   -4.4640   -0.0440 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7670   -2.5750   -0.3510 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4 13  1  0  0  0  0
  4 14  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 11  2  0  0  0  0
  7  8  2  0  0  0  0
  7 15  1  0  0  0  0
  8  9  1  0  0  0  0
  8 16  1  0  0  0  0
  9 10  2  0  0  0  0
  9 17  1  0  0  0  0
 10 11  1  0  0  0  0
 10 18  1  0  0  0  0
 11 12  1  0  0  0  0
M  CHG  1  11   1
M  CHG  1  12  -1
M  END