NWF
  CCTOOLS-0919241042

 76 80  0  0  1  0  0  0  0  0999 V2000
   17.4920   45.6980   17.7300 C   0  0  0  0  0
   18.1280   45.8660   12.4280 C   0  0  0  0  0
   16.2590   45.7550   10.9450 C   0  0  0  0  0
   17.9240   47.2210   12.5880 C   0  0  0  0  0
   13.0830   47.5180   13.8780 C   0  0  0  0  0
   17.4810   44.4090   16.9290 C   0  0  0  0  0
   17.4890   44.7310   15.4390 C   0  0  0  0  0
   19.2750   45.1830   13.1600 C   0  0  0  0  0
   17.2950   45.1310   11.6080 C   0  0  0  0  0
   16.0520   47.1100   11.1080 C   0  0  0  0  0
   16.8880   47.8450   11.9240 C   0  0  0  0  0
   13.5330   48.6140   12.8360 C   0  0  0  0  0
   12.6450   48.2970   15.1370 C   0  0  0  0  0
   14.3380   47.1110   14.6730 C   0  0  0  0  0
   17.1830   50.1590   15.1480 C   0  0  0  0  0
   18.6940   50.0720   15.2230 C   0  0  0  0  0
   19.0970   50.3320   16.6510 C   0  0  0  0  0
   18.5290   49.2980   17.4680 N   0  0  0  0  0
   17.0850   49.2040   17.4970 C   0  0  0  0  0
   16.5350   49.1250   16.0650 C   0  0  0  0  0
   19.4670   48.4420   18.1820 C   0  0  0  0  0
   19.1470   47.2640   19.1190 C   0  0  0  0  0
   18.7560   46.1010   18.3100 N   0  0  0  0  0
   19.0800   45.4430   14.9380 S   0  0  0  0  0
   14.9220   47.8060   10.3550 C   0  0  0  0  0
   13.3460   47.8140   11.2350 S   0  0  0  0  0
   14.2250   48.6020   15.2060 N   0  0  0  0  0
   15.0400   49.4130   16.0410 C   0  0  0  0  0
   14.5940   50.3880   16.5280 O   0  0  0  0  0
   20.6110   48.6750   18.0320 O   0  0  0  0  0
   16.4950   46.3020   17.8530 O   0  0  0  0  0
   18.1580   47.7220   20.1970 C   0  0  0  0  0
   17.3810   46.6770   20.8220 N   0  0  0  0  0
   17.7790   45.3430   21.2180 C   0  0  0  0  0
   16.6420   44.5570   21.8440 C   0  0  0  0  0
   16.0150   43.2310   21.3550 S   0  0  0  0  0
   14.8530   42.8950   22.3240 C   0  0  0  0  0
   14.7790   43.9390   23.3170 C   0  0  0  0  0
   15.9140   45.0020   23.0070 C   0  0  0  0  0
   18.8600   44.9040   21.0550 O   0  0  0  0  0
   13.7680   41.4920   22.2670 CL  0  0  0  0  0
   15.6100   45.1830   10.2980 H   0  0  0  0  0
   18.5750   47.7930   13.2330 H   0  0  0  0  0
   12.4220   46.7180   13.5130 H   0  0  0  0  0
   16.5760   43.8340   17.1740 H   0  0  0  0  0
   18.3720   43.8150   17.1800 H   0  0  0  0  0
   16.6880   45.4530   15.2220 H   0  0  0  0  0
   17.3130   43.8060   14.8700 H   0  0  0  0  0
   19.2610   44.1050   12.9420 H   0  0  0  0  0
   20.2320   45.6120   12.8280 H   0  0  0  0  0
   17.4540   44.0700   11.4860 H   0  0  0  0  0
   16.7310   48.9070   12.0430 H   0  0  0  0  0
   14.5800   48.9050   13.0050 H   0  0  0  0  0
   12.8890   49.5030   12.9040 H   0  0  0  0  0
   11.9940   49.1670   14.9630 H   0  0  0  0  0
   12.2360   47.6920   15.9590 H   0  0  0  0  0
   14.1920   46.3220   15.4250 H   0  0  0  0  0
   15.2310   46.8840   14.0730 H   0  0  0  0  0
   16.8640   51.1650   15.4570 H   0  0  0  0  0
   16.8620   49.9740   14.1120 H   0  0  0  0  0
   19.0270   49.0700   14.9160 H   0  0  0  0  0
   19.1460   50.8270   14.5630 H   0  0  0  0  0
   20.1930   50.3160   16.7380 H   0  0  0  0  0
   18.7180   51.3130   16.9730 H   0  0  0  0  0
   16.6720   50.0920   17.9970 H   0  0  0  0  0
   16.7900   48.3010   18.0510 H   0  0  0  0  0
   16.7180   48.1180   15.6630 H   0  0  0  0  0
   20.0840   47.0080   19.6360 H   0  0  0  0  0
   19.5070   45.4670   18.1250 H   0  0  0  0  0
   15.2200   48.8490   10.1710 H   0  0  0  0  0
   14.7780   47.2910    9.3940 H   0  0  0  0  0
   18.7300   48.2340   20.9850 H   0  0  0  0  0
   17.4580   48.4320   19.7330 H   0  0  0  0  0
   16.4270   46.9100   21.0090 H   0  0  0  0  0
   14.0720   43.9880   24.1320 H   0  0  0  0  0
   16.1080   45.9030   23.5690 H   0  0  0  0  0
  1 31  2  0  0  0
  1 23  1  0  0  0
  2  4  1  0  0  0
  2  8  1  0  0  0
  3 10  2  0  0  0
  3  9  1  0  0  0
  3 42  1  0  0  0
  4 43  1  0  0  0
  5 14  1  0  0  0
  5 13  1  0  0  0
  5 44  1  0  0  0
  6  1  1  0  0  0
  6 45  1  0  0  0
  6 46  1  0  0  0
  7  6  1  0  0  0
  7 47  1  0  0  0
  7 48  1  0  0  0
  8 24  1  0  0  0
  8 49  1  0  0  0
  8 50  1  0  0  0
  9  2  2  0  0  0
  9 51  1  0  0  0
 10 11  1  0  0  0
 11  4  2  0  0  0
 11 52  1  0  0  0
 12  5  1  0  0  0
 12 53  1  0  0  0
 12 54  1  0  0  0
 13 27  1  0  0  0
 13 55  1  0  0  0
 13 56  1  0  0  0
 14 27  1  0  0  0
 14 57  1  0  0  0
 14 58  1  0  0  0
 15 16  1  0  0  0
 15 20  1  0  0  0
 15 59  1  0  0  0
 15 60  1  0  0  0
 16 17  1  0  0  0
 16 61  1  0  0  0
 16 62  1  0  0  0
 17 18  1  0  0  0
 17 63  1  0  0  0
 17 64  1  0  0  0
 18 19  1  0  0  0
 18 21  1  0  0  0
 19 65  1  0  0  0
 19 66  1  0  0  0
 20 19  1  0  0  0
 20 67  1  0  0  0
 21 22  1  0  0  0
 22 32  1  0  0  0
 22 68  1  0  0  0
 23 22  1  0  0  0
 23 69  1  0  0  0
 24  7  1  0  0  0
 25 10  1  0  0  0
 25 26  1  0  0  0
 25 70  1  0  0  0
 25 71  1  0  0  0
 26 12  1  0  0  0
 27 28  1  0  0  0
 28 20  1  0  0  0
 28 29  2  0  0  0
 30 21  2  0  0  0
 32 33  1  0  0  0
 32 72  1  0  0  0
 32 73  1  0  0  0
 33 34  1  0  0  0
 33 74  1  0  0  0
 34 35  1  0  0  0
 35 39  2  0  0  0
 36 35  1  0  0  0
 36 37  1  0  0  0
 37 38  2  0  0  0
 38 75  1  0  0  0
 39 38  1  0  0  0
 39 76  1  0  0  0
 40 34  2  0  0  0
 41 37  1  0  0  0
M  END
$$$$
