A1I2A
  CCTOOLS-0116261006

 27 28  0  0  0  0  0  0  0  0999 V2000
    3.7100   -1.0630    1.0950 C   0  0  0  0  0
    2.3900   -1.0120   -0.9330 C   0  0  0  0  0
   -4.5160   -1.1410    0.3040 O   0  0  0  0  0
   -3.4000   -0.6690    0.1590 C   0  0  0  0  0
   -2.9390    0.2490    1.0290 N   0  0  0  0  0
   -1.7000    0.7850    0.8820 C   0  0  0  0  0
   -0.9010    0.4070   -0.1440 C   0  0  0  0  0
   -1.3520   -0.5470   -1.0670 C   0  0  0  0  0
   -2.5940   -1.0880   -0.9140 C   0  0  0  0  0
    0.7030    1.1130   -0.3180 S   0  0  0  0  0
    0.8630    1.4110   -1.6980 O   0  0  0  0  0
    0.8250    2.0900    0.7070 O   0  0  0  0  0
    1.8030   -0.0740    0.0340 N   0  0  0  0  0
    2.3550   -0.3650    1.3700 C   0  0  0  0  0
    3.3750   -1.9130   -0.1590 C   0  0  0  0  0
    4.4890   -0.3330    0.8750 H   0  0  0  0  0
    4.0000   -1.6990    1.9320 H   0  0  0  0  0
    1.6050   -1.6210   -1.3820 H   0  0  0  0  0
    2.9220   -0.4630   -1.7100 H   0  0  0  0  0
   -1.3480    1.5200    1.5900 H   0  0  0  0  0
   -0.7180   -0.8570   -1.8850 H   0  0  0  0  0
   -2.9590   -1.8240   -1.6150 H   0  0  0  0  0
    1.6890   -1.0320    1.9180 H   0  0  0  0  0
    2.5100    0.5590    1.9260 H   0  0  0  0  0
    4.2720   -2.1010   -0.7490 H   0  0  0  0  0
    2.8970   -2.8500    0.1270 H   0  0  0  0  0
   -3.4980    0.5310    1.7690 H   0  0  0  0  0
  1 15  1  0  0  0
  1 16  1  0  0  0
  1 17  1  0  0  0
  2 15  1  0  0  0
  2 18  1  0  0  0
  2 19  1  0  0  0
  4  3  2  0  0  0
  4  5  1  0  0  0
  5 27  1  0  0  0
  6  5  1  0  0  0
  6 20  1  0  0  0
  7  6  2  0  0  0
  8  9  2  0  0  0
  8  7  1  0  0  0
  8 21  1  0  0  0
  9  4  1  0  0  0
  9 22  1  0  0  0
 10 11  2  0  0  0
 10  7  1  0  0  0
 10 13  1  0  0  0
 12 10  2  0  0  0
 13  2  1  0  0  0
 14 13  1  0  0  0
 14  1  1  0  0  0
 14 23  1  0  0  0
 14 24  1  0  0  0
 15 25  1  0  0  0
 15 26  1  0  0  0
M  END
$$$$
