9AR
  CCTOOLS-0919241037

 37 40  0  0  0  0  0  0  0  0999 V2000
    0.0600    0.1050    2.4310 C   0  0  0  0  0
   -1.2080    0.1960    3.0050 C   0  0  0  0  0
   -2.3420    0.2050    2.2100 C   0  0  0  0  0
   -2.2320    0.1240    0.8240 C   0  0  0  0  0
   -0.9680    0.0260    0.2280 C   0  0  0  0  0
    0.1860    0.0200    1.0310 C   0  0  0  0  0
   -0.8240   -0.0520   -1.2310 C   0  0  0  0  0
    0.4680   -0.1490   -1.8040 C   0  0  0  0  0
    1.6100   -0.1610   -0.9930 C   0  0  0  0  0
    1.5080   -0.0790    0.3950 C   0  0  0  0  0
   -1.9480   -0.0390   -2.0550 C   0  0  0  0  0
   -1.8030   -0.1130   -3.4240 C   0  0  0  0  0
   -0.5410   -0.2020   -4.0010 C   0  0  0  0  0
    0.5940   -0.2180   -3.2090 C   0  0  0  0  0
   -4.3770   -0.1610    1.3670 C   0  0  0  0  0
    1.2590    0.0960    3.2840 C   0  0  0  0  0
    2.2620    1.0320   -4.0210 C   0  0  0  0  0
    1.8230   -0.3050   -3.7800 O   0  0  0  0  0
   -3.6660    0.2840    2.5370 O   0  0  0  0  0
   -3.4830    0.1520    0.2840 O   0  0  0  0  0
    2.0990    0.9660    3.1610 O   0  0  0  0  0
    1.4270   -0.8770    4.2010 O   0  0  0  0  0
   -0.4210   -0.2740   -5.3540 O   0  0  0  0  0
    2.8360   -1.1540    2.0570 O   0  0  0  0  0
    3.4260    0.8080    1.0500 O   0  5  0  0  0
    2.6120   -0.0920    1.1470 N   0  3  0  0  0
   -1.3060    0.2600    4.0790 H   0  0  0  0  0
    2.5860   -0.2360   -1.4500 H   0  0  0  0  0
   -2.9340    0.0280   -1.6200 H   0  0  0  0  0
   -2.6790   -0.1010   -4.0550 H   0  0  0  0  0
   -4.5590   -1.2350    1.4150 H   0  0  0  0  0
   -5.3160    0.3820    1.2590 H   0  0  0  0  0
    3.2500    1.0120   -4.4810 H   0  0  0  0  0
    1.5600    1.5310   -4.6880 H   0  0  0  0  0
    2.3130    1.5730   -3.0760 H   0  0  0  0  0
    2.2150   -0.8830    4.7620 H   0  0  0  0  0
   -0.4410   -1.2120   -5.5870 H   0  0  0  0  0
  1  2  2  0  0  0
  1  6  1  0  0  0
  1 16  1  0  0  0
  2  3  1  0  0  0
  2 27  1  0  0  0
  3  4  2  0  0  0
  3 19  1  0  0  0
  4  5  1  0  0  0
  4 20  1  0  0  0
  5  6  2  0  0  0
  5  7  1  0  0  0
  6 10  1  0  0  0
  7  8  2  0  0  0
  7 11  1  0  0  0
  8  9  1  0  0  0
  8 14  1  0  0  0
  9 10  2  0  0  0
  9 28  1  0  0  0
 10 26  1  0  0  0
 11 12  2  0  0  0
 11 29  1  0  0  0
 12 13  1  0  0  0
 12 30  1  0  0  0
 13 14  2  0  0  0
 13 23  1  0  0  0
 14 18  1  0  0  0
 15 19  1  0  0  0
 15 20  1  0  0  0
 15 31  1  0  0  0
 15 32  1  0  0  0
 16 21  2  0  0  0
 16 22  1  0  0  0
 17 18  1  0  0  0
 17 33  1  0  0  0
 17 34  1  0  0  0
 17 35  1  0  0  0
 22 36  1  0  0  0
 23 37  1  0  0  0
 24 26  2  0  0  0
 25 26  1  0  0  0
M  CHG  1  25  -1
M  CHG  1  26   1
M  END
$$$$
