PUBCHEM-ZINC02009203
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 31 33  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
   -1.2010   -0.6380    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3780    0.1110    0.0250 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5960   -0.4980    0.0340 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6810   -1.8990    0.0270 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9280   -2.5540    0.0360 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0100   -3.9070    0.0290 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8660   -4.7140    0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6000   -4.1220    0.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4910   -2.6680    0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2480   -2.0200   -0.0030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0980   -2.7450   -0.0240 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4660   -3.1030    1.2400 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6430   -5.2260   -0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3730   -6.3530   -0.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6820   -6.0500    0.0030 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8190   -7.7260   -0.0250 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.6120   -7.8960   -0.0380 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5680   -8.6860   -0.0240 O   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
   -2.3220    1.1900    0.0310 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4970    0.0970    0.0470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8350   -1.9680    0.0480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9840   -4.3750    0.0360 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000   -2.1990    1.8020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2490   -3.7050    1.8000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3790   -3.6770    1.0800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5660   -5.1510   -0.0220 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 21  1  0  0  0  0
  1 22  1  0  0  0  0
  1 23  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3 12  2  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 25  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 26  1  0  0  0  0
  8  9  1  0  0  0  0
  8 27  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 15  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 28  1  0  0  0  0
 14 29  1  0  0  0  0
 14 30  1  0  0  0  0
 15 16  2  0  0  0  0
 15 31  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
M  CHG  1  18   1
M  CHG  1  20  -1
M  END