T2E
  CCTOOLS-0919241032

 31 32  0  0  0  0  0  0  0  0999 V2000
   -1.5270    1.7520    0.0060 C   0  0  0  0  0
   -3.3620   -0.3430   -0.0140 C   0  0  0  0  0
   -1.5170   -2.0130   -0.0490 C   0  0  0  0  0
    4.6090    0.0950   -1.1740 C   0  0  0  0  0
    3.3190    0.6050   -1.1730 C   0  0  0  0  0
    2.6580    0.7260    0.0390 C   0  0  0  0  0
    3.3010    0.3370    1.1990 C   0  0  0  0  0
    5.1860   -0.2780    0.0250 C   0  0  0  0  0
    1.2550    1.2750    0.0920 C   0  0  0  0  0
   -1.0700    0.4400   -0.0180 C   0  0  0  0  0
   -2.8810    2.0140    0.0260 C   0  0  0  0  0
   -3.8000    0.9690    0.0160 C   0  0  0  0  0
   -1.9910   -0.6190   -0.0230 C   0  0  0  0  0
    4.5290   -0.1440    1.1600 N   0  0  0  0  0
    0.2960    0.1760   -0.0390 N   0  0  0  0  0
   -5.1720    1.2460    0.0250 N   0  0  0  0  0
   -2.3990   -3.0270    0.0530 O   0  0  0  0  0
   -0.3300   -2.2490   -0.1630 O   0  0  0  0  0
   -0.8200    2.5680    0.0140 H   0  0  0  0  0
   -4.0770   -1.1520   -0.0220 H   0  0  0  0  0
    5.1540   -0.0130   -2.1000 H   0  0  0  0  0
    2.8410    0.9010   -2.0960 H   0  0  0  0  0
    2.7930    0.4290    2.1480 H   0  0  0  0  0
    6.1890   -0.6760    0.0330 H   0  0  0  0  0
    1.0990    1.7820    1.0440 H   0  0  0  0  0
    1.1110    1.9830   -0.7240 H   0  0  0  0  0
   -3.2290    3.0360    0.0510 H   0  0  0  0  0
    0.6120   -0.7350   -0.1400 H   0  0  0  0  0
   -5.8140    0.5190    0.0100 H   0  0  0  0  0
   -5.4810    2.1660    0.0470 H   0  0  0  0  0
   -2.0400   -3.9250    0.0310 H   0  0  0  0  0
  1 11  2  0  0  0
  1 19  1  0  0  0
  2 12  2  0  0  0
  2 20  1  0  0  0
  3 13  1  0  0  0
  4  5  1  0  0  0
  4 21  1  0  0  0
  5 22  1  0  0  0
  6  9  1  0  0  0
  6  5  2  0  0  0
  7  6  1  0  0  0
  7 23  1  0  0  0
  8  4  2  0  0  0
  8 24  1  0  0  0
  9 25  1  0  0  0
  9 26  1  0  0  0
 10 13  2  0  0  0
 10  1  1  0  0  0
 11 12  1  0  0  0
 11 27  1  0  0  0
 12 16  1  0  0  0
 13  2  1  0  0  0
 14  7  2  0  0  0
 14  8  1  0  0  0
 15  9  1  0  0  0
 15 10  1  0  0  0
 15 28  1  0  0  0
 16 29  1  0  0  0
 16 30  1  0  0  0
 17  3  1  0  0  0
 17 31  1  0  0  0
 18  3  2  0  0  0
M  END
$$$$
