PD9
  CCTOOLS-0919241031

 37 37  0  0  0  0  0  0  0  0999 V2000
   -3.1670    0.6160   -0.0290 C   0  0  0  0  0
   -1.9250    1.1930    0.1010 C   0  0  0  0  0
   -3.3140   -0.7610    0.0880 C   0  0  0  0  0
   -0.9510   -0.9990    0.4590 C   0  0  0  0  0
   -0.8020    0.3910    0.3470 C   0  0  0  0  0
    0.5230    1.0010    0.4800 C   0  0  0  0  0
    1.5220   -0.9990   -0.4820 C   0  0  0  0  0
    1.4210   -2.0140   -0.9810 N   0  0  0  0  0
    2.9840    0.8260    0.4420 C   0  0  0  0  0
    3.0940    1.8460    1.0970 O   0  0  0  0  0
    5.4120    0.7620    0.2430 C   0  0  0  0  0
    3.9550   -1.0550   -0.7650 C   0  0  0  0  0
    5.7930    1.7070   -0.8980 C   0  0  0  0  0
   -5.4530    0.9550   -0.4030 O   0  0  0  0  0
   -4.3520    1.4640   -0.2880 N   0  3  0  0  0
   -4.2270    2.6720   -0.3860 O   0  5  0  0  0
   -4.5430   -1.3240   -0.0360 O   0  0  0  0  0
   -2.2010   -1.5680    0.3330 C   0  0  0  0  0
   -2.3500   -2.9150    0.4410 O   0  0  0  0  0
    1.6500    0.2800    0.1480 C   0  0  0  0  0
    4.0850    0.1960   -0.0130 N   0  0  0  0  0
    3.7930   -2.2220    0.2110 C   0  0  0  0  0
   -1.8150    2.2640    0.0130 H   0  0  0  0  0
   -0.0890   -1.6230    0.6480 H   0  0  0  0  0
    0.6160    2.0160    0.8370 H   0  0  0  0  0
    6.1440   -0.0430    0.3080 H   0  0  0  0  0
    5.3960    1.3140    1.1830 H   0  0  0  0  0
    3.0800   -1.0000   -1.4130 H   0  0  0  0  0
    4.8470   -1.2090   -1.3710 H   0  0  0  0  0
    5.0610    2.5120   -0.9620 H   0  0  0  0  0
    6.7800    2.1280   -0.7070 H   0  0  0  0  0
    5.8090    1.1540   -1.8370 H   0  0  0  0  0
   -4.7710   -1.5740   -0.9410 H   0  0  0  0  0
   -2.5190   -3.2210    1.3430 H   0  0  0  0  0
    3.6970   -3.1530   -0.3480 H   0  0  0  0  0
    4.6680   -2.2770    0.8590 H   0  0  0  0  0
    2.9010   -2.0680    0.8170 H   0  0  0  0  0
  1 15  1  0  0  0
  2  1  2  0  0  0
  2 23  1  0  0  0
  3  1  1  0  0  0
  3 17  1  0  0  0
  4  5  2  0  0  0
  4 18  1  0  0  0
  4 24  1  0  0  0
  5  2  1  0  0  0
  6  5  1  0  0  0
  6 25  1  0  0  0
  7  8  3  0  0  0
  9 10  2  0  0  0
  9 20  1  0  0  0
 11 21  1  0  0  0
 11 26  1  0  0  0
 11 27  1  0  0  0
 12 21  1  0  0  0
 12 28  1  0  0  0
 12 29  1  0  0  0
 13 11  1  0  0  0
 13 30  1  0  0  0
 13 31  1  0  0  0
 13 32  1  0  0  0
 15 16  1  0  0  0
 15 14  2  0  0  0
 17 33  1  0  0  0
 18  3  2  0  0  0
 19 18  1  0  0  0
 19 34  1  0  0  0
 20  7  1  0  0  0
 20  6  2  0  0  0
 21  9  1  0  0  0
 22 12  1  0  0  0
 22 35  1  0  0  0
 22 36  1  0  0  0
 22 37  1  0  0  0
M  CHG  1  15   1
M  CHG  1  16  -1
M  END
$$$$
