A1E3Y
  CCTOOLS-0501261012

 23 23  0  0  1  0  0  0  0  0999 V2000
    0.7600    1.6540    0.6940 N   0  0  0  0  0
    3.0960    0.1790    0.8760 O   0  0  0  0  0
   -3.6760   -0.2990   -0.3530 C   0  0  0  0  0
   -3.0490   -1.1600    0.5280 C   0  0  0  0  0
   -2.9630    0.7300   -0.9390 C   0  0  0  0  0
   -1.7090   -0.9920    0.8240 C   0  0  0  0  0
   -1.6240    0.9020   -0.6390 C   0  0  0  0  0
    1.3140   -0.3730   -0.5640 C   0  0  0  0  0
    2.7710   -0.3000   -0.1850 C   0  0  0  0  0
   -0.9960    0.0380    0.2380 C   0  0  0  0  0
    0.4640    0.2210    0.5610 C   0  0  0  0  0
    3.7070   -0.7660   -1.0260 O   0  0  0  0  0
    0.5530    2.1470   -0.1630 H   0  0  0  0  0
    0.2590    2.0560    1.4720 H   0  0  0  0  0
   -4.7210   -0.4330   -0.5880 H   0  0  0  0  0
   -3.6060   -1.9650    0.9850 H   0  0  0  0  0
   -3.4510    1.4000   -1.6310 H   0  0  0  0  0
   -1.2200   -1.6650    1.5120 H   0  0  0  0  0
   -1.0670    1.7060   -1.0960 H   0  0  0  0  0
    1.1480    0.1910   -1.4810 H   0  0  0  0  0
    1.0310   -1.4140   -0.7210 H   0  0  0  0  0
    0.6960   -0.2850    1.4980 H   0  0  0  0  0
    4.6280   -0.6980   -0.7400 H   0  0  0  0  0
  1 13  1  0  0  0
  1 14  1  0  0  0
  3  5  2  0  0  0
  3 15  1  0  0  0
  4  6  2  0  0  0
  4  3  1  0  0  0
  4 16  1  0  0  0
  5  7  1  0  0  0
  5 17  1  0  0  0
  6 10  1  0  0  0
  6 18  1  0  0  0
  7 19  1  0  0  0
  8 11  1  0  0  0
  8 20  1  0  0  0
  8 21  1  0  0  0
  9  8  1  0  0  0
  9  2  2  0  0  0
  9 12  1  0  0  0
 10 11  1  0  0  0
 10  7  2  0  0  0
 11  1  1  0  0  0
 11 22  1  0  0  0
 12 23  1  0  0  0
M  END
$$$$
