A1C1J
  CCTOOLS-0821261018

 29 31  0  0  0  0  0  0  0  0999 V2000
   -0.1810    1.5800   -0.0640 C   0  0  0  0  0
   -3.9010    0.9390    0.0730 C   0  0  0  0  0
   -3.7870   -1.4510    0.0630 C   0  0  0  0  0
   -1.7620   -0.1520   -0.0100 C   0  0  0  0  0
    0.5840   -0.7950   -0.0980 C   0  0  0  0  0
    2.0000   -0.3760   -0.0280 C   0  0  0  0  0
    3.0190   -1.3290    0.0890 C   0  0  0  0  0
    4.3280   -0.8850    0.1510 C   0  0  0  0  0
    4.5860    0.4730    0.0950 C   0  0  0  0  0
    2.3440    0.9750   -0.0840 C   0  0  0  0  0
   -1.5880    2.1960   -0.0100 C   0  0  0  0  0
   -2.5220    1.0070    0.0220 C   0  0  0  0  0
   -4.5360   -0.2890    0.0940 C   0  0  0  0  0
   -2.4110   -1.3880    0.0110 C   0  0  0  0  0
    3.6050    1.3480   -0.0160 N   0  0  0  0  0
   -0.3950    0.1310   -0.0600 N   0  0  0  0  0
    0.3030   -1.9740   -0.1910 O   0  0  0  0  0
    0.3300    1.8850   -0.9770 H   0  0  0  0  0
    0.3980    1.8800    0.8100 H   0  0  0  0  0
   -4.4850    1.8480    0.0980 H   0  0  0  0  0
   -4.2820   -2.4110    0.0790 H   0  0  0  0  0
    2.7890   -2.3830    0.1310 H   0  0  0  0  0
    5.1410   -1.5910    0.2420 H   0  0  0  0  0
    5.6070    0.8220    0.1430 H   0  0  0  0  0
    1.5690    1.7220   -0.1790 H   0  0  0  0  0
   -1.7070    2.7960    0.8920 H   0  0  0  0  0
   -1.7720    2.8030   -0.8960 H   0  0  0  0  0
   -5.6140   -0.3410    0.1340 H   0  0  0  0  0
   -1.8310   -2.2990   -0.0120 H   0  0  0  0  0
  1 16  1  0  0  0
  1 18  1  0  0  0
  1 19  1  0  0  0
  2 12  2  0  0  0
  2 20  1  0  0  0
  3 13  2  0  0  0
  3 21  1  0  0  0
  4 14  2  0  0  0
  5 17  2  0  0  0
  6  5  1  0  0  0
  6 10  1  0  0  0
  7  6  2  0  0  0
  7 22  1  0  0  0
  8  7  1  0  0  0
  8 23  1  0  0  0
  9  8  2  0  0  0
  9 24  1  0  0  0
 10 15  2  0  0  0
 10 25  1  0  0  0
 11  1  1  0  0  0
 11 26  1  0  0  0
 11 27  1  0  0  0
 12 11  1  0  0  0
 12  4  1  0  0  0
 13  2  1  0  0  0
 13 28  1  0  0  0
 14  3  1  0  0  0
 14 29  1  0  0  0
 15  9  1  0  0  0
 16  5  1  0  0  0
 16  4  1  0  0  0
M  END
$$$$
