NCID-ZINC00339012
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.4250    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6060   -0.6070   -1.0560 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1680    0.1600   -2.0650 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7820   -0.4550   -3.1390 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8360   -1.8350   -3.2090 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2760   -2.6020   -2.2040 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6660   -1.9920   -1.1250 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1740   -3.1550    0.4010 I   0  0  0  0  0  0  0  0  0  0  0  0
    2.4940   -2.4910   -4.3610 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.9870   -1.8160   -5.2460 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5420   -3.7070   -4.4230 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0050    1.8020    0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5440    1.7860   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5280    1.7760    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1260    1.2380   -2.0120 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2190    0.1430   -3.9260 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3190   -3.6800   -2.2610 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  8  2  0  0  0  0
  4  5  2  0  0  0  0
  4 16  1  0  0  0  0
  5  6  1  0  0  0  0
  5 17  1  0  0  0  0
  6  7  2  0  0  0  0
  6 10  1  0  0  0  0
  7  8  1  0  0  0  0
  7 18  1  0  0  0  0
  8  9  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
M  CHG  1  10   1
M  CHG  1  12  -1
M  END