S4I
  CCTOOLS-0801250956

 26 27  0  0  0  0  0  0  0  0999 V2000
    1.5280   -0.0480    0.9400 N   0  0  0  0  0
    2.1430    1.2650    0.7100 C   0  0  0  0  0
    3.2320    1.0360   -0.3130 C   0  0  0  0  0
    0.4190   -0.3370    1.8540 C   0  0  0  0  0
   -1.4470   -1.2690    0.4710 C   0  0  0  0  0
   -2.7350    1.1780    0.4380 C   0  0  0  0  0
    3.2130   -0.2750   -0.6120 C   0  0  0  0  0
    4.0450   -0.8900   -1.4990 O   0  0  0  0  0
    2.1630   -0.9380    0.1550 C   0  0  0  0  0
    1.9030   -2.1260    0.0970 O   0  0  0  0  0
    4.0630    1.9680   -0.8270 O   0  0  0  0  0
   -0.8880   -0.1840    1.1210 C   0  0  0  0  0
   -2.6460   -1.1300   -0.2010 C   0  0  0  0  0
   -3.2910    0.0940   -0.2190 C   0  0  0  0  0
   -1.5300    1.0400    1.1000 C   0  0  0  0  0
   -4.8050    0.2660   -1.0510 CL  0  0  0  0  0
    1.4020    1.9640    0.3210 H   0  0  0  0  0
    2.5700    1.6480    1.6370 H   0  0  0  0  0
    0.5110   -1.3580    2.2250 H   0  0  0  0  0
    0.4490    0.3590    2.6920 H   0  0  0  0  0
   -0.9430   -2.2240    0.4840 H   0  0  0  0  0
   -3.2380    2.1330    0.4240 H   0  0  0  0  0
    3.8890   -1.8400   -1.5890 H   0  0  0  0  0
   -3.0800   -1.9760   -0.7140 H   0  0  0  0  0
   -1.0940    1.8870    1.6080 H   0  0  0  0  0
    4.6950    1.6200   -1.4720 H   0  0  0  0  0
  1  4  1  0  0  0
  2  1  1  0  0  0
  2 17  1  0  0  0
  2 18  1  0  0  0
  3  2  1  0  0  0
  4 12  1  0  0  0
  4 19  1  0  0  0
  4 20  1  0  0  0
  5 13  2  0  0  0
  5 21  1  0  0  0
  6 14  2  0  0  0
  6 22  1  0  0  0
  7  3  2  0  0  0
  7  9  1  0  0  0
  8  7  1  0  0  0
  8 23  1  0  0  0
  9  1  1  0  0  0
 10  9  2  0  0  0
 11  3  1  0  0  0
 11 26  1  0  0  0
 12  5  1  0  0  0
 13 24  1  0  0  0
 14 13  1  0  0  0
 14 16  1  0  0  0
 15 12  2  0  0  0
 15  6  1  0  0  0
 15 25  1  0  0  0
M  END
$$$$
