7X4
  CCTOOLS-0919241030

 42 45  0  0  0  0  0  0  0  0999 V2000
   12.9970    6.3020   11.7750 C   0  0  0  0  0
   13.7700    5.2890   12.1410 N   0  0  0  0  0
   13.2940    4.0690   12.4650 C   0  0  0  0  0
   11.9390    3.8910   12.3760 C   0  0  0  0  0
   11.1140    4.9740   11.9830 C   0  0  0  0  0
    9.7270    4.8120   11.9070 N   0  0  0  0  0
    9.0770    3.6200   12.2740 C   0  0  0  0  0
    9.0510    3.2020   13.6120 C   0  0  0  0  0
    9.5940    3.8200   14.7130 O   0  0  0  0  0
    9.5910    2.7890   15.7330 C   0  0  0  0  0
    8.5220    1.8730   15.3200 O   0  0  0  0  0
    8.4030    2.0170   13.9740 C   0  0  0  0  0
    7.7650    1.2030   13.0270 C   0  0  0  0  0
    7.8440    1.6470   11.6930 C   0  0  0  0  0
    8.4750    2.8400   11.3010 C   0  0  0  0  0
    8.5480    3.3740    9.6200 CL  0  0  0  0  0
   11.6620    6.1650   11.7000 N   0  0  0  0  0
   15.5190   12.2480    9.5740 N   0  0  0  0  0
   14.6830   12.4160   10.9870 S   0  0  0  0  0
   15.6060   12.1570   12.0490 O   0  0  0  0  0
   13.9320   13.6460   10.9730 O   0  0  0  0  0
   13.5240   11.0960   11.0400 C   0  0  0  0  0
   12.1580   11.3120   10.9290 C   0  0  0  0  0
   11.2720   10.2470   10.9780 C   0  0  0  0  0
   11.7510    8.9500   11.1610 C   0  0  0  0  0
   13.1240    8.7400   11.2790 C   0  0  0  0  0
   13.6840    7.4780   11.4750 N   0  0  0  0  0
   14.0120    9.8250   11.2270 C   0  0  0  0  0
   14.6780    7.4090   11.3920 H   0  0  0  0  0
   13.9500    3.2710   12.7800 H   0  0  0  0  0
   11.5020    2.9300   12.6040 H   0  0  0  0  0
    9.1730    5.5770   11.5770 H   0  0  0  0  0
   10.5610    2.2730   15.7810 H   0  0  0  0  0
    9.4250    3.1980   16.7400 H   0  0  0  0  0
    7.2470    0.2960   13.3020 H   0  0  0  0  0
    7.3930    1.0350   10.9260 H   0  0  0  0  0
   14.8770   12.2140    8.8080 H   0  0  0  0  0
   16.1360   13.0260    9.4570 H   0  0  0  0  0
   11.7820   12.3170   10.8040 H   0  0  0  0  0
   15.0740    9.6620   11.3330 H   0  0  0  0  0
   10.2110   10.4220   10.8750 H   0  0  0  0  0
   11.0650    8.1170   11.2110 H   0  0  0  0  0
  1  2  1  0  0  0
  1 17  2  0  0  0
  1 27  1  0  0  0
  2  3  2  0  0  0
  3  4  1  0  0  0
  3 30  1  0  0  0
  4  5  2  0  0  0
  4 31  1  0  0  0
  5  6  1  0  0  0
  5 17  1  0  0  0
  6  7  1  0  0  0
  6 32  1  0  0  0
  7  8  1  0  0  0
  7 15  2  0  0  0
  8  9  1  0  0  0
  8 12  2  0  0  0
  9 10  1  0  0  0
 10 11  1  0  0  0
 10 33  1  0  0  0
 10 34  1  0  0  0
 11 12  1  0  0  0
 12 13  1  0  0  0
 13 14  2  0  0  0
 13 35  1  0  0  0
 14 15  1  0  0  0
 14 36  1  0  0  0
 15 16  1  0  0  0
 18 19  1  0  0  0
 18 37  1  0  0  0
 18 38  1  0  0  0
 19 20  2  0  0  0
 19 21  2  0  0  0
 19 22  1  0  0  0
 22 23  1  0  0  0
 22 28  2  0  0  0
 23 24  2  0  0  0
 23 39  1  0  0  0
 24 25  1  0  0  0
 24 41  1  0  0  0
 25 26  2  0  0  0
 25 42  1  0  0  0
 26 27  1  0  0  0
 26 28  1  0  0  0
 27 29  1  0  0  0
 28 40  1  0  0  0
M  END
$$$$
