A1DPD
  CCTOOLS-0807261401

 27 27  0  0  0  0  0  0  0  0999 V2000
    5.2800   -0.5060   -0.0130 C   0  0  0  0  0
    4.0250    0.1500   -0.2050 O   0  0  0  0  0
    2.8980   -0.6100    0.2350 C   0  0  0  0  0
    1.6350    0.1730   -0.0140 C   0  0  0  0  0
    1.6940    1.2730   -0.5200 O   0  0  0  0  0
    0.4400   -0.3500    0.3240 N   0  0  0  0  0
   -0.7160    0.4170    0.2010 C   0  0  0  0  0
   -0.6420    1.8020    0.2480 C   0  0  0  0  0
   -1.7890    2.5600    0.1250 C   0  0  0  0  0
   -3.0200    1.9480   -0.0450 C   0  0  0  0  0
   -3.1130    0.5730   -0.0930 C   0  0  0  0  0
   -1.9600   -0.2070    0.0230 C   0  0  0  0  0
   -2.0510   -1.6780   -0.0340 C   0  0  0  0  0
   -1.0620   -2.3570    0.1620 O   0  0  0  0  0
   -3.2320   -2.2700   -0.3050 N   0  0  0  0  0
    5.4250   -0.7090    1.0480 H   0  0  0  0  0
    5.2890   -1.4440   -0.5670 H   0  0  0  0  0
    6.0840    0.1360   -0.3720 H   0  0  0  0  0
    2.8580   -1.5510   -0.3140 H   0  0  0  0  0
    2.9930   -0.8160    1.3020 H   0  0  0  0  0
    0.3850   -1.2610    0.6540 H   0  0  0  0  0
    0.3140    2.2870    0.3800 H   0  0  0  0  0
   -1.7270    3.6380    0.1620 H   0  0  0  0  0
   -3.9120    2.5500   -0.1400 H   0  0  0  0  0
   -4.0750    0.1000   -0.2250 H   0  0  0  0  0
   -4.0210   -1.7290   -0.4610 H   0  0  0  0  0
   -3.2920   -3.2380   -0.3420 H   0  0  0  0  0
  1  2  1  0  0  0
  1 16  1  0  0  0
  1 17  1  0  0  0
  1 18  1  0  0  0
  2  3  1  0  0  0
  3  4  1  0  0  0
  3 19  1  0  0  0
  3 20  1  0  0  0
  4  5  2  0  0  0
  4  6  1  0  0  0
  6  7  1  0  0  0
  6 21  1  0  0  0
  7  8  2  0  0  0
  7 12  1  0  0  0
  8  9  1  0  0  0
  8 22  1  0  0  0
  9 10  2  0  0  0
  9 23  1  0  0  0
 10 11  1  0  0  0
 10 24  1  0  0  0
 11 12  2  0  0  0
 11 25  1  0  0  0
 12 13  1  0  0  0
 13 14  2  0  0  0
 13 15  1  0  0  0
 15 26  1  0  0  0
 15 27  1  0  0  0
M  END
$$$$
