A1J8Z
  CCTOOLS-0731261038

 44 46  0  0  1  0  0  0  0  0999 V2000
   -1.6180   -0.9100    0.1350 N   0  0  0  0  0
    0.6740   -0.1780   -0.2290 C   0  0  0  0  0
   -1.2530   -1.3830    1.4810 C   0  0  0  0  0
   -2.6700   -1.3130   -2.0600 O   0  0  0  0  0
    1.0850   -1.1640    0.6300 C   0  0  0  0  0
    0.1240   -2.0380    1.3920 C   0  0  0  0  0
    1.6130    0.5800   -0.9160 C   0  0  0  0  0
   -0.7830    0.1400   -0.4570 C   0  0  0  0  0
    3.8790    1.1040   -1.4100 O   0  0  0  0  0
   -1.6880    2.4720   -0.5660 C   0  0  0  0  0
   -1.9960    3.6830    0.0240 C   0  0  0  0  0
   -1.7290    3.8860    1.3650 C   0  0  0  0  0
   -1.1540    2.8780    2.1160 C   0  0  0  0  0
   -0.8460    1.6660    1.5260 C   0  0  0  0  0
   -1.1130    1.4630    0.1840 C   0  0  0  0  0
    2.9650    0.3570   -0.7350 C   0  0  0  0  0
    3.3720    2.1050   -2.2950 C   0  0  0  0  0
    3.3850   -0.6370    0.1450 C   0  0  0  0  0
    4.7120   -0.8640    0.3360 O   0  0  0  0  0
    5.0670   -1.9010    1.2530 C   0  0  0  0  0
    2.4440   -1.3880    0.8190 C   0  0  0  0  0
   -2.9130   -1.5430   -0.6790 S   0  0  0  0  0
   -3.1370   -2.8360   -0.1340 O   0  0  0  0  0
   -4.2360   -0.6310   -0.2790 N   0  0  0  0  0
   -1.2170   -0.5410    2.1710 H   0  0  0  0  0
   -1.9870   -2.1130    1.8260 H   0  0  0  0  0
    0.5090   -2.2020    2.3980 H   0  0  0  0  0
    0.0330   -2.9980    0.8830 H   0  0  0  0  0
    1.2840    1.3500   -1.5980 H   0  0  0  0  0
   -0.9780    0.1990   -1.5280 H   0  0  0  0  0
   -1.9000    2.3120   -1.6130 H   0  0  0  0  0
   -2.4450    4.4710   -0.5630 H   0  0  0  0  0
   -1.9690    4.8330    1.8260 H   0  0  0  0  0
   -0.9450    3.0370    3.1630 H   0  0  0  0  0
   -0.3970    0.8790    2.1120 H   0  0  0  0  0
    4.2040    2.6260   -2.7690 H   0  0  0  0  0
    2.7540    1.6350   -3.0600 H   0  0  0  0  0
    2.7710    2.8180   -1.7300 H   0  0  0  0  0
    4.6650   -1.6670    2.2390 H   0  0  0  0  0
    4.6550   -2.8490    0.9080 H   0  0  0  0  0
    6.1530   -1.9770    1.3130 H   0  0  0  0  0
    2.7660   -2.1600    1.5020 H   0  0  0  0  0
   -4.1440    0.1160    0.3330 H   0  0  0  0  0
   -5.1040   -0.8430   -0.6580 H   0  0  0  0  0
  1 22  1  0  0  0
  2  5  2  0  0  0
  3  1  1  0  0  0
  3  6  1  0  0  0
  3 25  1  0  0  0
  3 26  1  0  0  0
  5  6  1  0  0  0
  6 27  1  0  0  0
  6 28  1  0  0  0
  7  2  1  0  0  0
  7 29  1  0  0  0
  8  2  1  0  0  0
  8  1  1  0  0  0
  8 30  1  0  0  0
  9 16  1  0  0  0
 10 15  2  0  0  0
 10 31  1  0  0  0
 11 10  1  0  0  0
 11 32  1  0  0  0
 12 11  2  0  0  0
 12 13  1  0  0  0
 12 33  1  0  0  0
 13 14  2  0  0  0
 13 34  1  0  0  0
 14 15  1  0  0  0
 14 35  1  0  0  0
 15  8  1  0  0  0
 16  7  2  0  0  0
 16 18  1  0  0  0
 17  9  1  0  0  0
 17 36  1  0  0  0
 17 37  1  0  0  0
 17 38  1  0  0  0
 18 21  2  0  0  0
 19 18  1  0  0  0
 19 20  1  0  0  0
 20 39  1  0  0  0
 20 40  1  0  0  0
 20 41  1  0  0  0
 21  5  1  0  0  0
 21 42  1  0  0  0
 22  4  2  0  0  0
 22 23  2  0  0  0
 24 22  1  0  0  0
 24 43  1  0  0  0
 24 44  1  0  0  0
M  END
$$$$
