PUBCHEM-ZINC05830313
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 17  0  0  1  0  0  0  0  0999 V2000
   -0.0190    1.5260    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.5880   -0.3550   -0.8470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4290   -0.5330   -0.1130 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.8770   -0.1700   -1.0380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4080   -2.0630   -0.1210 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7310   -2.5560   -0.3450 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2190   -0.0600    1.0320 N   0  5  0  0  0  0  0  0  0  0  0  0
   -1.8240   -0.3830    1.9020 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6060   -0.4920    1.2490 N   0  5  0  0  0  0  0  0  0  0  0  0
    0.0800   -0.1800    2.0520 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3220    2.0200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5460    1.8870   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5290    1.8770    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7500   -2.4130   -0.9170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0430   -2.4260    0.8390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7930   -3.5210   -0.3630 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3850    2.9850    0.0050 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 10  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4  8  1  0  0  0  0
  6  7  1  0  0  0  0
  6 15  1  0  0  0  0
  6 16  1  0  0  0  0
  7 17  1  0  0  0  0
  8  9  1  0  0  0  0
 10 11  1  0  0  0  0
 12 18  1  0  0  0  0
M  CHG  1   8  -1
M  CHG  1  10  -1
M  END