A1C5N
  CCTOOLS-0828261229

 34 34  0  0  0  0  0  0  0  0999 V2000
   -2.3140    0.0030   -0.7330 C   0  0  0  0  0
   -5.8100   -0.0160    0.8820 C   0  0  0  0  0
    2.1510   -1.2150   -0.3680 C   0  0  0  0  0
    3.4260   -1.1820    0.1880 C   0  0  0  0  0
    4.0110    0.0450    0.4610 C   0  0  0  0  0
    2.1580    1.1720   -0.3210 C   0  0  0  0  0
    1.5130   -0.0120   -0.6260 C   0  0  0  0  0
    0.1340    0.0050   -1.2320 C   0  0  0  0  0
   -0.9140   -0.0140   -0.1170 C   0  0  0  0  0
   -3.3620   -0.0150    0.3820 C   0  0  0  0  0
   -4.7620    0.0020   -0.2330 C   0  0  0  0  0
   -7.2100    0.0010    0.2660 C   0  0  0  0  0
    3.3700    1.1690    0.2010 N   0  3  0  0  0
    4.0900   -2.3370    0.4590 O   0  0  0  0  0
    3.9970    2.4040    0.4940 O   0  5  0  0  0
   -2.4370    0.9060   -1.3320 H   0  0  0  0  0
   -2.4430   -0.8740   -1.3670 H   0  0  0  0  0
   -5.6870   -0.9190    1.4800 H   0  0  0  0  0
   -5.6810    0.8610    1.5160 H   0  0  0  0  0
    1.6710   -2.1550   -0.5960 H   0  0  0  0  0
    5.0010    0.0820    0.8920 H   0  0  0  0  0
    1.6660    2.1130   -0.5200 H   0  0  0  0  0
    0.0110    0.9070   -1.8310 H   0  0  0  0  0
    0.0050   -0.8720   -1.8660 H   0  0  0  0  0
   -0.7850    0.8630    0.5170 H   0  0  0  0  0
   -0.7910   -0.9160    0.4820 H   0  0  0  0  0
   -3.2390   -0.9180    0.9810 H   0  0  0  0  0
   -3.2330    0.8620    1.0160 H   0  0  0  0  0
   -4.8910   -0.8750   -0.8680 H   0  0  0  0  0
   -4.8850    0.9040   -0.8320 H   0  0  0  0  0
   -7.3330    0.9030   -0.3330 H   0  0  0  0  0
   -7.3390   -0.8770   -0.3680 H   0  0  0  0  0
   -7.9560   -0.0130    1.0600 H   0  0  0  0  0
    3.9290   -2.6840    1.3470 H   0  0  0  0  0
  1 10  1  0  0  0
  1 16  1  0  0  0
  1 17  1  0  0  0
  2 18  1  0  0  0
  2 19  1  0  0  0
  3  7  2  0  0  0
  3 20  1  0  0  0
  4  5  2  0  0  0
  4  3  1  0  0  0
  5 13  1  0  0  0
  5 21  1  0  0  0
  6  7  1  0  0  0
  6 22  1  0  0  0
  7  8  1  0  0  0
  8  9  1  0  0  0
  8 23  1  0  0  0
  8 24  1  0  0  0
  9  1  1  0  0  0
  9 25  1  0  0  0
  9 26  1  0  0  0
 10 11  1  0  0  0
 10 27  1  0  0  0
 10 28  1  0  0  0
 11  2  1  0  0  0
 11 29  1  0  0  0
 11 30  1  0  0  0
 12  2  1  0  0  0
 12 31  1  0  0  0
 12 32  1  0  0  0
 12 33  1  0  0  0
 13 15  1  0  0  0
 13  6  2  0  0  0
 14  4  1  0  0  0
 14 34  1  0  0  0
M  CHG  1  13   1
M  CHG  1  15  -1
M  END
$$$$
