PUBCHEM-ZINC01532613
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 16  0  0  0  0  0  0  0  0999 V2000
   -0.1070    1.5750    0.0370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1200    0.0440    0.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5200   -0.5400    0.0450 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5530    0.1220    0.1000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6770   -2.0610    0.0170 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5880   -2.7140   -0.0390 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.3190    2.1250   -0.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4590    3.6530    0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3880    4.3180    0.0770 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6820    1.9660   -0.8120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6140    1.9290    0.9440 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3650   -0.3070   -0.9130 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4330   -0.3460    0.8660 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8850    1.7300    0.8460 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8160    1.7680   -0.9180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8540   -2.5430    0.0520 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6550    4.0690   -0.0180 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  7  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  2  3  1  0  0  0  0
  2 12  1  0  0  0  0
  2 13  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 16  2  0  0  0  0
  7  8  1  0  0  0  0
  7 14  1  0  0  0  0
  7 15  1  0  0  0  0
  8  9  2  0  0  0  0
  8 17  1  0  0  0  0
M  CHG  1   6  -1
M  CHG  1  17  -1
M  END