PUBCHEM-ZINC06112917
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
    0.2590    0.3840   -1.0540 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6630   -0.7910   -1.5220 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4070   -0.9490   -1.3710 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.5310    0.6490   -0.6480 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2710    1.2080   -0.5610 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0210    2.5410   -0.0030 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9480    3.2110    0.4110 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7770    1.2880   -0.2060 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5970    0.6460    0.6230 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1630   -0.6160    1.2630 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.0200   -1.0100    1.1190 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9500   -1.2610    1.9330 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.7790    0.6820   -1.0580 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0110   -1.5440   -1.9390 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0290    2.2790   -0.5550 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5790    1.0460    0.8290 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2370    3.0240    0.0520 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3520    3.9080    0.4280 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  5  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 17  1  0  0  0  0
  8  9  2  0  0  0  0
  8 15  1  0  0  0  0
  9 10  1  0  0  0  0
  9 16  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 17 18  1  0  0  0  0
M  CHG  1  10   1
M  CHG  1  12  -1
M  END