NCID-ZINC01870454
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.3780    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2080   -0.6790   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3960    0.0290   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3770    1.4120   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1710    2.0860    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1500    3.5660    0.0100 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0870    4.1600    0.0230 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1960    4.1900    0.0030 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.2250   -0.9940   -0.0420 I   0  0  0  0  0  0  0  0  0  0  0  0
    1.2280   -2.1860   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1120   -2.6800   -0.0100 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9590    1.9060    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9260   -0.5570    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3050    1.9640   -0.0180 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7390   -2.5380   -0.9160 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7560   -2.5460    0.8630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1760   -3.6450   -0.0130 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 11  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5 15  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 11 12  1  0  0  0  0
 11 16  1  0  0  0  0
 11 17  1  0  0  0  0
 12 18  1  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  END