PLI
  CCTOOLS-0919241032

 36 36  0  0  0  0  0  0  0  0999 V2000
   -4.0130    1.9040   -1.1790 O   0  0  0  0  0
   -4.1790    0.9810   -0.0350 P   0  0  0  0  0
   -4.1680    1.8200    1.3390 O   0  0  0  0  0
   -5.5790    0.1990   -0.1750 O   0  0  0  0  0
   -2.9690   -0.0820   -0.0240 O   0  0  0  0  0
   -1.5940    0.3040   -0.0150 C   0  0  0  0  0
   -0.7260   -0.9280   -0.0060 C   0  0  0  0  0
   -1.2870   -2.1590   -0.0070 C   0  0  0  0  0
   -0.5160   -3.2740    0.0010 N   0  0  0  0  0
    0.8400   -3.1980    0.0100 C   0  0  0  0  0
    1.6590   -4.4630    0.0190 C   0  0  0  0  0
    1.4640   -1.9920    0.0110 C   0  0  0  0  0
    2.8220   -1.9200    0.0190 O   0  0  0  0  0
    0.6830   -0.8090   -0.0030 C   0  0  0  0  0
    1.2980    0.4600   -0.0070 C   0  0  0  0  0
    2.6130    0.5550   -0.0040 N   0  0  0  0  0
    3.1920    1.7500   -0.0090 C   0  0  0  0  0
    2.3460    2.9970   -0.0170 C   0  0  0  0  0
    4.5840    1.8500   -0.0050 C   0  0  0  0  0
    5.1160    2.9480   -0.0090 O   0  0  0  0  0
    5.3430    0.7310    0.0030 O   0  0  0  0  0
   -4.2720    1.2780    2.1320 H   0  0  0  0  0
   -6.3530    0.7780   -0.1880 H   0  0  0  0  0
   -1.3770    0.8940   -0.9060 H   0  0  0  0  0
   -1.3890    0.8990    0.8740 H   0  0  0  0  0
   -2.3630   -2.2550   -0.0130 H   0  0  0  0  0
   -0.9420   -4.1450    0.0000 H   0  0  0  0  0
    0.9930   -5.3260    0.0170 H   0  0  0  0  0
    2.2930   -4.4910   -0.8670 H   0  0  0  0  0
    2.2810   -4.4860    0.9130 H   0  0  0  0  0
    3.2620   -2.7820    0.0240 H   0  0  0  0  0
    0.6920    1.3540   -0.0140 H   0  0  0  0  0
    2.1390    3.3030    1.0080 H   0  0  0  0  0
    2.8800    3.7950   -0.5340 H   0  0  0  0  0
    1.4070    2.7960   -0.5330 H   0  0  0  0  0
    6.2950    0.9010    0.0050 H   0  0  0  0  0
  1  2  2  0  0  0
  2  3  1  0  0  0
  2  4  1  0  0  0
  2  5  1  0  0  0
  3 22  1  0  0  0
  4 23  1  0  0  0
  5  6  1  0  0  0
  6  7  1  0  0  0
  6 24  1  0  0  0
  6 25  1  0  0  0
  7  8  2  0  0  0
  7 14  1  0  0  0
  8  9  1  0  0  0
  8 26  1  0  0  0
  9 10  1  0  0  0
  9 27  1  0  0  0
 10 11  1  0  0  0
 10 12  2  0  0  0
 11 28  1  0  0  0
 11 29  1  0  0  0
 11 30  1  0  0  0
 12 13  1  0  0  0
 12 14  1  0  0  0
 13 31  1  0  0  0
 14 15  2  0  0  0
 15 16  1  0  0  0
 15 32  1  0  0  0
 16 17  2  0  0  0
 17 18  1  0  0  0
 17 19  1  0  0  0
 18 33  1  0  0  0
 18 34  1  0  0  0
 18 35  1  0  0  0
 19 20  2  0  0  0
 19 21  1  0  0  0
 21 36  1  0  0  0
M  END
$$$$