RSW
  CCTOOLS-0828261229

 50 61  0  0  0  0  0  0  0  0999 V2000
    1.6600    1.6430    5.1940 O   0  0  0  0  0
    0.1320   -3.4290   -0.5900 CL  0  5  0  0  0
    0.0160   -1.1860   -1.4340 RU  0  0  0  0  0
    0.3480   -0.1000    1.2230 C   0  0  0  0  0
    1.1880   -0.4900    0.2210 N   0  5  0  0  0
   -2.8860    1.3690    5.0050 O   0  0  0  0  0
    2.4890   -0.2350    0.6970 C   0  0  0  0  0
    2.7010   -2.5380   -4.1880 O   0  0  0  0  0
    3.7220   -0.4460    0.0840 C   0  0  0  0  0
    0.7080   -3.1800   -4.9420 O   0  0  0  0  0
    4.8640   -0.1020    0.7840 C   0  0  0  0  0
    4.8000    0.4410    2.0660 C   0  0  0  0  0
    3.5780    0.6560    2.6860 C   0  0  0  0  0
    2.4030    0.3170    2.0010 C   0  0  0  0  0
    0.9960    0.3970    2.3280 C   0  0  0  0  0
    0.2090    0.8220    3.4080 C   0  0  0  0  0
    0.5580    1.4000    4.7330 C   0  0  0  0  0
   -0.6320    1.6320    5.3990 N   0  0  0  0  0
   -1.7290    1.2620    4.6370 C   0  0  0  0  0
   -1.2020    0.7380    3.3490 C   0  0  0  0  0
   -1.8610    0.2160    2.1880 C   0  0  0  0  0
   -3.2550    0.0930    2.0400 C   0  0  0  0  0
   -3.7690   -0.4280    0.8750 C   0  0  0  0  0
   -2.8570   -0.8200   -0.1380 C   0  0  0  0  0
   -1.5500   -0.7140   -0.0300 N   0  0  0  0  0
   -1.0510   -0.2020    1.1240 C   0  0  0  0  0
   -5.2580   -0.5850    0.6540 C   0  0  0  0  0
    0.7980   -1.2580   -3.5000 C   0  0  0  0  0
   -0.5820   -1.0860   -3.5520 C   0  0  0  0  0
   -1.1870   -0.0430   -2.8650 C   0  0  0  0  0
   -0.4340    0.8410   -2.1310 C   0  0  0  0  0
    0.9310    0.6920   -2.0790 C   0  0  0  0  0
    1.5480   -0.3440   -2.7640 C   0  0  0  0  0
    1.4800   -2.3770   -4.2380 C   0  0  0  0  0
    3.7740   -0.8110   -0.7760 H   0  0  0  0  0
    5.7040   -0.2380    0.3850 H   0  0  0  0  0
    5.5980    0.6650    2.5160 H   0  0  0  0  0
    3.5420    1.0200    3.5450 H   0  0  0  0  0
   -0.6920    1.9730    6.2090 H   0  0  0  0  0
   -3.8280    0.3570    2.7230 H   0  0  0  0  0
   -3.2070   -1.1700   -0.9280 H   0  0  0  0  0
   -5.7060   -0.7100    1.5080 H   0  0  0  0  0
   -5.4260   -1.3590    0.0890 H   0  0  0  0  0
   -5.6060    0.2110    0.2200 H   0  0  0  0  0
   -1.1160   -1.6850   -4.0450 H   0  0  0  0  0
   -2.1240    0.0580   -2.9030 H   0  0  0  0  0
   -0.8510    1.5510   -1.6700 H   0  0  0  0  0
    1.4510    1.3000   -1.5790 H   0  0  0  0  0
    2.4830   -0.4360   -2.7150 H   0  0  0  0  0
    1.1660   -3.8160   -5.3490 H   0  0  0  0  0
  1 17  2  0  0  0
  2  3  1  0  0  0
  3 29  1  0  0  0
  3 25  1  0  0  0
  3 30  1  0  0  0
  3 28  1  0  0  0
  3 31  1  0  0  0
  3 33  1  0  0  0
  3 32  1  0  0  0
  4 26  1  0  0  0
  5  4  1  0  0  0
  5  3  1  0  0  0
  7 14  1  0  0  0
  7  5  1  0  0  0
  9  7  2  0  0  0
  9 35  1  0  0  0
 10 34  1  0  0  0
 10 50  1  0  0  0
 11 12  2  0  0  0
 11  9  1  0  0  0
 11 36  1  0  0  0
 12 13  1  0  0  0
 12 37  1  0  0  0
 13 14  2  0  0  0
 13 38  1  0  0  0
 14 15  1  0  0  0
 15  4  2  0  0  0
 15 16  1  0  0  0
 16 20  2  0  0  0
 17 16  1  0  0  0
 17 18  1  0  0  0
 18 19  1  0  0  0
 18 39  1  0  0  0
 19  6  2  0  0  0
 20 19  1  0  0  0
 20 21  1  0  0  0
 21 22  2  0  0  0
 22 23  1  0  0  0
 22 40  1  0  0  0
 23 27  1  0  0  0
 24 23  2  0  0  0
 24 41  1  0  0  0
 25 24  1  0  0  0
 26 25  2  0  0  0
 26 21  1  0  0  0
 27 42  1  0  0  0
 27 43  1  0  0  0
 27 44  1  0  0  0
 28 33  1  0  0  0
 29 30  1  0  0  0
 29 28  2  0  0  0
 29 45  1  0  0  0
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 31 32  1  0  0  0
 31 47  1  0  0  0
 32 48  1  0  0  0
 33 32  2  0  0  0
 33 49  1  0  0  0
 34 28  1  0  0  0
 34  8  2  0  0  0
M  CHG  1   2  -1
M  CHG  1   5  -1
M  END
$$$$
