ASINEX-ZINC00245210
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
   -0.0170    1.3880    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
    1.0940   -0.8510   -0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4700   -0.5080   -0.0230 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2550   -1.4460   -0.0350 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0460    0.7750   -0.0220 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4100    1.9970   -0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0440    2.2690    0.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6810    3.7040    0.0150 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.4910    4.0350    0.0270 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5540    4.5530    0.0110 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.8150   -2.1770   -0.0170 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9980    1.8400    0.0160 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9640   -0.4860    0.0090 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1250    0.8070   -0.0320 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0590    2.8600   -0.0110 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5980   -2.7440   -0.0270 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  8  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 12  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 15  1  0  0  0  0
  7  8  1  0  0  0  0
  7 16  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 12 17  1  0  0  0  0
M  CHG  1   9   1
M  CHG  1  11  -1
M  END