ST1
  CCTOOLS-0919241031

 25 25  0  0  0  0  0  0  0  0999 V2000
   -0.2750    0.1560   -0.1900 C   0  0  0  0  0
   -0.3400    0.2300   -1.4210 O   0  0  0  0  0
   -1.2450    0.6640    0.6180 O   0  0  0  0  0
    0.8070   -0.4630    0.5610 C   0  0  0  0  0
    0.7640   -0.4840    1.9550 C   0  0  0  0  0
    1.8000   -1.0790    2.6760 C   0  0  0  0  0
    1.7360   -1.0880    4.0380 O   0  0  0  0  0
    2.8780   -1.6520    2.0020 C   0  0  0  0  0
    3.9120   -2.2460    2.7370 N   0  0  0  0  0
    4.0140   -3.5760    3.1570 C   0  0  0  0  0
    3.2150   -4.4860    2.9600 O   0  0  0  0  0
    5.2870   -3.8190    3.9280 C   0  0  0  0  0
    2.9210   -1.6310    0.6080 C   0  0  0  0  0
    4.0090   -2.2080   -0.1060 N   0  3  0  0  0
    4.9400   -2.7420    0.5400 O   0  0  0  0  0
    4.0010   -2.1640   -1.3580 O   0  5  0  0  0
    1.8850   -1.0360   -0.1120 C   0  0  0  0  0
   -1.9800    1.0830    0.1210 H   0  0  0  0  0
   -0.0760   -0.0380    2.4840 H   0  0  0  0  0
    1.0390   -0.4880    4.3440 H   0  0  0  0  0
    4.6890   -1.6330    2.9980 H   0  0  0  0  0
    6.1510   -3.6290    3.2840 H   0  0  0  0  0
    5.3200   -4.8570    4.2700 H   0  0  0  0  0
    5.3270   -3.1580    4.7990 H   0  0  0  0  0
    1.9150   -1.0180   -1.2000 H   0  0  0  0  0
  1  2  2  0  0  0
  1  3  1  0  0  0
  1  4  1  0  0  0
  3 18  1  0  0  0
  4  5  2  0  0  0
  4 17  1  0  0  0
  5  6  1  0  0  0
  5 19  1  0  0  0
  6  7  1  0  0  0
  6  8  2  0  0  0
  7 20  1  0  0  0
  8  9  1  0  0  0
  8 13  1  0  0  0
  9 10  1  0  0  0
  9 21  1  0  0  0
 10 11  2  0  0  0
 10 12  1  0  0  0
 12 22  1  0  0  0
 12 23  1  0  0  0
 12 24  1  0  0  0
 13 14  1  0  0  0
 13 17  2  0  0  0
 14 15  2  0  0  0
 14 16  1  0  0  0
 17 25  1  0  0  0
M  CHG  1  14   1
M  CHG  1  16  -1
M  END
$$$$