PUBCHEM-ZINC04670957
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 19  0  0  0  0  0  0  0  0999 V2000
   -0.0250    1.3390    0.0190 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0370    0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3130   -0.4270   -0.0210 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6400   -1.3840   -0.0370 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1380    0.6750   -0.0170 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3230    1.8090    0.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9450    3.0760    0.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3460    3.1620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1500    2.0120   -0.0250 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5370    0.7460   -0.0340 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6600    2.1280   -0.0420 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3240    1.0440   -0.0640 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.8380    4.8510    0.0530 I   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9220    1.9430    0.0380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7950   -0.7680    0.0010 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8330    4.1370    0.0060 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1440   -0.1570   -0.0530 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1510    3.3010   -0.0330 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 14  1  0  0  0  0
  2  3  1  0  0  0  0
  2 15  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 10  2  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  7 13  1  0  0  0  0
  8  9  2  0  0  0  0
  8 16  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 17  1  0  0  0  0
 11 12  1  0  0  0  0
 11 18  2  0  0  0  0
M  CHG  1  12  -1
M  END