TQE
  CCTOOLS-0919241035

 25 25  0  0  0  0  0  0  0  0999 V2000
    2.8760    0.9110   -0.0040 C   0  0  0  0  0
    1.0000   -0.5650   -0.0010 C   0  0  0  0  0
   -0.9150   -1.9120    0.0010 C   0  0  0  0  0
   -1.4400   -3.0130    0.0030 O   0  0  0  0  0
    0.4300   -1.8030    0.0010 N   0  0  0  0  0
   -1.6670   -0.8100   -0.0030 N   0  0  0  0  0
   -1.0970    0.3890    0.0050 C   0  0  0  0  0
   -1.8820    1.5160    0.0010 N   0  0  0  0  0
   -3.3420    1.3920   -0.0110 C   0  0  0  0  0
   -1.2600    2.8420    0.0090 C   0  0  0  0  0
    0.2340    0.5090    0.0000 N   0  0  0  0  0
    2.3420   -0.4390   -0.0000 O   0  0  0  0  0
    4.4050    0.8540   -0.0020 C   0  0  0  0  0
    2.5340    1.4360   -0.8950 H   0  0  0  0  0
    2.5320    1.4400    0.8850 H   0  0  0  0  0
    0.9850   -2.5980    0.0040 H   0  0  0  0  0
   -3.7120    1.3590    1.0140 H   0  0  0  0  0
   -3.7750    2.2490   -0.5260 H   0  0  0  0  0
   -3.6240    0.4750   -0.5290 H   0  0  0  0  0
   -1.0970    3.1730   -1.0160 H   0  0  0  0  0
   -1.9150    3.5480    0.5200 H   0  0  0  0  0
   -0.3040    2.7910    0.5310 H   0  0  0  0  0
    4.7500    0.3240   -0.8900 H   0  0  0  0  0
    4.8070    1.8670   -0.0040 H   0  0  0  0  0
    4.7480    0.3290    0.8900 H   0  0  0  0  0
  1 12  1  0  0  0
  1 13  1  0  0  0
  1 14  1  0  0  0
  1 15  1  0  0  0
  2  5  1  0  0  0
  2 12  1  0  0  0
  3  4  2  0  0  0
  3  5  1  0  0  0
  5 16  1  0  0  0
  6  3  1  0  0  0
  7  6  2  0  0  0
  7 11  1  0  0  0
  8  7  1  0  0  0
  9  8  1  0  0  0
  9 17  1  0  0  0
  9 18  1  0  0  0
  9 19  1  0  0  0
 10  8  1  0  0  0
 10 20  1  0  0  0
 10 21  1  0  0  0
 10 22  1  0  0  0
 11  2  2  0  0  0
 13 23  1  0  0  0
 13 24  1  0  0  0
 13 25  1  0  0  0
M  END
$$$$