A1JJG
  CCTOOLS-0710261011

 49 51  0  0  1  0  0  0  0  0999 V2000
    3.2890    1.8160   -0.1650 N   0  0  0  0  0
    4.0940    0.5980   -0.3460 C   0  0  0  0  0
    2.1860    2.1390   -0.8680 C   0  0  0  0  0
    1.4530    3.4220   -0.5710 C   0  0  0  0  0
    3.8860    2.6200    0.9170 C   0  0  0  0  0
    5.3740    2.1910    0.9560 C   0  0  0  0  0
    2.0790   -0.4960    0.6590 C   0  0  0  0  0
   -1.1160   -1.2190    0.7510 C   0  0  0  0  0
   -3.4250   -1.2280   -0.9370 C   0  0  0  0  0
   -5.4780   -0.0710   -1.3600 C   0  0  0  0  0
    1.7110   -2.8540    0.4620 C   0  0  0  0  0
    2.8860   -2.9770   -0.2540 C   0  0  0  0  0
    4.9310   -1.9930   -1.3110 C   0  0  0  0  0
    1.3070   -1.6130    0.9190 C   0  0  0  0  0
    0.0260   -1.4770    1.7000 C   0  0  0  0  0
   -3.4110   -0.7280    0.3590 C   0  0  0  0  0
   -4.4570   -0.8960   -1.7930 C   0  0  0  0  0
   -5.4650    0.4330   -0.0710 C   0  0  0  0  0
   -4.4350    0.1040    0.7900 C   0  0  0  0  0
    3.6530   -1.8590   -0.5240 C   0  0  0  0  0
    3.2520   -0.6190   -0.0620 C   0  0  0  0  0
    5.2660    0.6710    0.6550 C   0  0  0  0  0
   -2.3670   -1.0630    1.2280 N   0  0  0  0  0
    1.7830    1.3980   -1.7390 O   0  0  0  0  0
   -0.9100   -1.1520   -0.4420 O   0  0  0  0  0
   -6.7430    1.4790    0.4640 CL  0  0  0  0  0
    4.4790    0.5560   -1.3650 H   0  0  0  0  0
    1.8590    4.2240   -1.1880 H   0  0  0  0  0
    0.3930    3.2950   -0.7920 H   0  0  0  0  0
    1.5760    3.6750    0.4820 H   0  0  0  0  0
    3.8040    3.6830    0.6880 H   0  0  0  0  0
    3.4010    2.3970    1.8670 H   0  0  0  0  0
    5.9490    2.7030    0.1850 H   0  0  0  0  0
    5.8040    2.3630    1.9420 H   0  0  0  0  0
    1.7640    0.4730    1.0160 H   0  0  0  0  0
   -2.6270   -1.8720   -1.2760 H   0  0  0  0  0
   -6.2840    0.1870   -2.0320 H   0  0  0  0  0
    1.1120   -3.7270    0.6730 H   0  0  0  0  0
    3.2060   -3.9480   -0.6040 H   0  0  0  0  0
    5.7600   -2.1820   -0.6290 H   0  0  0  0  0
    4.8410   -2.8230   -2.0120 H   0  0  0  0  0
    5.1170   -1.0710   -1.8620 H   0  0  0  0  0
    0.1120   -0.6460    2.3990 H   0  0  0  0  0
   -0.1620   -2.3980    2.2520 H   0  0  0  0  0
   -4.4650   -1.2810   -2.8020 H   0  0  0  0  0
   -4.4270    0.4940    1.7970 H   0  0  0  0  0
    5.0320    0.1160    1.5640 H   0  0  0  0  0
    6.1850    0.2990    0.2020 H   0  0  0  0  0
   -2.5440   -1.1840    2.1740 H   0  0  0  0  0
  1  3  1  0  0  0
  1  5  1  0  0  0
  2  1  1  0  0  0
  2 22  1  0  0  0
  2 27  1  0  0  0
  3  4  1  0  0  0
  3 24  2  0  0  0
  4 28  1  0  0  0
  4 29  1  0  0  0
  4 30  1  0  0  0
  5  6  1  0  0  0
  5 31  1  0  0  0
  5 32  1  0  0  0
  6 22  1  0  0  0
  6 33  1  0  0  0
  6 34  1  0  0  0
  7 14  2  0  0  0
  7 35  1  0  0  0
  8 23  1  0  0  0
  8 25  2  0  0  0
  9 17  1  0  0  0
  9 36  1  0  0  0
 10 18  1  0  0  0
 10 37  1  0  0  0
 11 12  2  0  0  0
 11 38  1  0  0  0
 12 39  1  0  0  0
 13 20  1  0  0  0
 13 40  1  0  0  0
 13 41  1  0  0  0
 13 42  1  0  0  0
 14 15  1  0  0  0
 14 11  1  0  0  0
 15  8  1  0  0  0
 15 43  1  0  0  0
 15 44  1  0  0  0
 16  9  2  0  0  0
 16 19  1  0  0  0
 17 10  2  0  0  0
 17 45  1  0  0  0
 18 26  1  0  0  0
 18 19  2  0  0  0
 19 46  1  0  0  0
 20 21  2  0  0  0
 20 12  1  0  0  0
 21  2  1  0  0  0
 21  7  1  0  0  0
 22 47  1  0  0  0
 22 48  1  0  0  0
 23 16  1  0  0  0
 23 49  1  0  0  0
M  END
$$$$
