IBS-ZINC04073937
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 21  0  0  1  0  0  0  0  0999 V2000
   -0.0130    1.0860    0.0080 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4200    1.6390   -0.0030 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.1450    0.8700   -0.2700 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6420    2.1620    1.4400 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.2270    1.4840    2.0600 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3420    3.5220    1.1950 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.7470    4.3350    1.6110 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4270    3.6480   -0.3120 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1780    4.3720   -0.9210 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5250    2.8000   -0.8700 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6500    3.5190    1.7710 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3310    2.4200    1.9680 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6310    1.6040    1.3160 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.5290    2.1820    1.0960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9620    0.5020    2.1640 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7430    1.5780   -1.1180 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1350    4.3460    1.6480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3580    0.7600    3.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6620    1.2790   -1.1520 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1 14  1  0  0  0  0
  1 17  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3 11  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 13  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 12  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 12 18  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
M  END