A1ETK
  CCTOOLS-1212251000

 40 43  0  0  0  0  0  0  0  0999 V2000
   -3.6180   -0.7940    1.0780 C   0  0  0  0  0
   -5.0820    0.5310   -0.2690 N   0  0  0  0  0
    2.9880   -0.8980    0.1980 C   0  0  0  0  0
    3.6740   -2.1130    0.4040 C   0  0  0  0  0
    3.6940    1.5380   -0.2440 C   0  0  0  0  0
    6.1430    1.5520   -0.7410 C   0  0  0  0  0
    0.9410    0.2970    0.9690 C   0  0  0  0  0
    1.5150   -0.7090    0.1960 C   0  0  0  0  0
    0.7070   -1.5370   -0.5800 C   0  0  0  0  0
   -0.6640   -1.3600   -0.5810 C   0  0  0  0  0
   -1.2370   -0.3530    0.1930 C   0  0  0  0  0
   -0.4300    0.4730    0.9670 C   0  0  0  0  0
   -5.0030   -0.3380    0.7490 C   0  0  0  0  0
    3.9230    0.0690    0.0080 C   0  0  0  0  0
    5.0170    2.2780    0.0010 C   0  0  0  0  0
    6.4130    0.2010   -0.0710 C   0  0  0  0  0
   -0.9870    1.4450    1.7220 F   0  0  0  0  0
   -2.6270   -0.1720    0.1910 N   0  0  0  0  0
    5.1420   -0.5130    0.0840 N   0  0  0  0  0
    4.9580   -1.8750    0.3320 N   0  0  0  0  0
   -1.4540   -2.1670   -1.3390 O   0  0  0  0  0
   -3.4500    0.2380   -2.1230 O   0  0  0  0  0
   -3.2030    2.1450   -0.5140 O   0  0  0  0  0
   -5.9800   -0.7240    1.3550 O   0  0  0  0  0
   -3.5330    0.7980   -0.8190 S   0  0  0  0  0
   -3.3910   -0.5280    2.1110 H   0  0  0  0  0
   -3.5640   -1.8770    0.9690 H   0  0  0  0  0
   -5.8920    0.9310   -0.6200 H   0  0  0  0  0
    3.2170   -3.0750    0.5890 H   0  0  0  0  0
    3.3740    1.6890   -1.2750 H   0  0  0  0  0
    5.8490    1.3900   -1.7780 H   0  0  0  0  0
    1.5660    0.9360    1.5740 H   0  0  0  0  0
    1.1520   -2.3180   -1.1810 H   0  0  0  0  0
    4.9360    3.3000   -0.3690 H   0  0  0  0  0
    7.0890   -0.3860   -0.6920 H   0  0  0  0  0
   -1.7570   -2.9640   -0.8810 H   0  0  0  0  0
    2.9310    1.9140    0.4380 H   0  0  0  0  0
    7.0480    2.1600   -0.7110 H   0  0  0  0  0
    5.2340    2.2910    1.0690 H   0  0  0  0  0
    6.8640    0.3630    0.9090 H   0  0  0  0  0
  1 13  1  0  0  0
  1 26  1  0  0  0
  1 27  1  0  0  0
  2 13  1  0  0  0
  2 28  1  0  0  0
  3  8  1  0  0  0
  3 14  2  0  0  0
  4  3  1  0  0  0
  4 29  1  0  0  0
  5 15  1  0  0  0
  5 30  1  0  0  0
  5 37  1  0  0  0
  6 15  1  0  0  0
  6 31  1  0  0  0
  6 38  1  0  0  0
  7 12  1  0  0  0
  7 32  1  0  0  0
  8  7  2  0  0  0
  9 10  2  0  0  0
  9  8  1  0  0  0
  9 33  1  0  0  0
 10 11  1  0  0  0
 11 18  1  0  0  0
 11 12  2  0  0  0
 12 17  1  0  0  0
 13 24  2  0  0  0
 14  5  1  0  0  0
 15 34  1  0  0  0
 15 39  1  0  0  0
 16  6  1  0  0  0
 16 35  1  0  0  0
 16 40  1  0  0  0
 18  1  1  0  0  0
 19 16  1  0  0  0
 19 14  1  0  0  0
 20  4  2  0  0  0
 20 19  1  0  0  0
 21 10  1  0  0  0
 21 36  1  0  0  0
 22 25  2  0  0  0
 25 18  1  0  0  0
 25  2  1  0  0  0
 25 23  2  0  0  0
M  END
$$$$
