PUBCHEM-ZINC05830115
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 17  0  0  1  0  0  0  0  0999 V2000
    0.2200    1.4920    0.1490 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1010   -0.0360   -0.0170 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.7560   -0.5340    0.7100 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5450   -0.3990   -1.3880 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8640   -0.6400   -2.4800 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3500   -0.5300    0.1990 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.9770   -0.2220   -0.6480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4970   -2.0930    0.3140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6190   -2.4600    0.7860 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6520    2.0270    0.0970 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5560    1.2260    0.4600 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3790    2.0020   -0.6170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1690    1.8050    1.1250 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5060   -2.7870   -0.0330 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.9890    0.0240    1.4350 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3870   -0.2070    2.2270 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8110   -0.5900    1.5760 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7500    3.2280   -0.2840 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 10  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  6  1  0  0  0  0
  4  5  3  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6 15  1  0  0  0  0
  8  9  2  0  0  0  0
  8 14  1  0  0  0  0
 10 11  2  0  0  0  0
 10 18  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
M  CHG  1  14  -1
M  CHG  1  18  -1
M  END