PUBCHEM-ZINC04473001
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
    0.0080    1.3850    0.1480 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0210    0.0010    0.1480 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2410   -0.6500   -0.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4020    0.1160   -0.1700 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3390    1.4420   -0.1620 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1990    2.0780   -0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7070   -0.5560   -0.3430 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7690   -1.7690   -0.3500 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3040   -2.0060   -0.0210 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5540   -2.6120    1.1550 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6170   -1.9560    2.1750 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7340   -3.9440    1.2000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9220    1.9200    0.2670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8930   -0.5600    0.2700 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1890    3.1580   -0.0110 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9110   -4.3340    2.0670 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8270    0.1770   -0.4930 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6570   -0.3070   -0.6030 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 13  1  0  0  0  0
  2  3  2  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  3  9  1  0  0  0  0
  4  5  2  0  0  0  0
  4  7  1  0  0  0  0
  5  6  1  0  0  0  0
  6 15  1  0  0  0  0
  7  8  2  0  0  0  0
  7 17  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 12 16  1  0  0  0  0
 17 18  1  0  0  0  0
M  END