IBS-ZINC02339660
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 19  0  0  0  0  0  0  0  0999 V2000
   -0.0360    1.3230    0.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0160   -0.0730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2780   -0.6780   -0.0170 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4740    0.0560   -0.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5440   -0.8940   -0.0450 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9730   -2.1410   -0.0420 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6170   -2.0120   -0.0250 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9830   -2.8020   -0.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6340   -3.4240   -0.0530 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9020   -3.4400   -0.0690 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.3890    1.4660   -0.0250 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1300    2.0860   -0.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0930    2.6790   -0.0430 I   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0030    1.8200    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8940   -0.6650    0.0100 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6070   -0.6920   -0.0580 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0460    3.1700   -0.0040 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8640   -4.4360   -0.0460 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 12  2  0  0  0  0
  1 14  1  0  0  0  0
  2  3  2  0  0  0  0
  2 15  1  0  0  0  0
  3  4  1  0  0  0  0
  3  7  1  0  0  0  0
  4  5  1  0  0  0  0
  4 11  2  0  0  0  0
  5  6  2  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  6  9  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  1  0  0  0  0
  9 18  2  0  0  0  0
 11 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 17  1  0  0  0  0
M  CHG  1  10  -1
M  END