A1JSI
  CCTOOLS-0515260948

 30 31  0  0  0  0  0  0  0  0999 V2000
   -3.3260    1.6220    1.4780 C   0  0  0  0  0
    0.6580   -1.4220    0.4100 C   0  0  0  0  0
    1.3510   -1.0420    1.5550 C   0  0  0  0  0
    2.5540   -0.3930    1.4460 C   0  0  0  0  0
    3.0840   -0.1130    0.1830 C   0  0  0  0  0
    2.3840   -0.4960   -0.9660 C   0  0  0  0  0
    1.1820   -1.1450   -0.8500 C   0  0  0  0  0
    4.3760    0.5850    0.0620 C   0  0  0  0  0
   -2.8080    2.6670    0.7380 C   0  0  0  0  0
   -1.9950    2.4060   -0.3530 C   0  0  0  0  0
   -1.7030    1.0980   -0.6990 C   0  0  0  0  0
   -2.2220    0.0540    0.0430 C   0  0  0  0  0
   -3.0290    0.3160    1.1340 C   0  0  0  0  0
   -1.4880    3.4270   -1.0780 F   0  0  0  0  0
   -0.5590   -2.0850    0.5240 N   0  0  0  0  0
    4.9830    0.9180    1.0600 O   0  0  0  0  0
    4.8850    0.8540   -1.1570 O   0  0  0  0  0
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   -1.3920   -1.5770   -1.7430 O   0  0  0  0  0
   -1.8500   -1.6110   -0.3980 S   0  0  0  0  0
   -3.9610    1.8250    2.3280 H   0  0  0  0  0
    0.9420   -1.2580    2.5310 H   0  0  0  0  0
    3.0920   -0.0980    2.3350 H   0  0  0  0  0
    2.7900   -0.2820   -1.9440 H   0  0  0  0  0
    0.6410   -1.4420   -1.7370 H   0  0  0  0  0
   -3.0370    3.6870    1.0090 H   0  0  0  0  0
   -1.0690    0.8930   -1.5500 H   0  0  0  0  0
   -3.4340   -0.5010    1.7140 H   0  0  0  0  0
   -0.6510   -2.8260    1.1440 H   0  0  0  0  0
    5.7360    1.3140   -1.1860 H   0  0  0  0  0
  1  9  2  0  0  0
  1 21  1  0  0  0
  2  3  2  0  0  0
  3  4  1  0  0  0
  3 22  1  0  0  0
  4  5  2  0  0  0
  4 23  1  0  0  0
  5  6  1  0  0  0
  5  8  1  0  0  0
  6  7  2  0  0  0
  6 24  1  0  0  0
  7  2  1  0  0  0
  7 25  1  0  0  0
  8 16  2  0  0  0
  8 17  1  0  0  0
  9 10  1  0  0  0
  9 26  1  0  0  0
 10 11  2  0  0  0
 10 14  1  0  0  0
 11 12  1  0  0  0
 11 27  1  0  0  0
 12 13  2  0  0  0
 12 20  1  0  0  0
 13  1  1  0  0  0
 13 28  1  0  0  0
 15  2  1  0  0  0
 15 29  1  0  0  0
 17 30  1  0  0  0
 20 18  2  0  0  0
 20 19  2  0  0  0
 20 15  1  0  0  0
M  END
$$$$
